Mercurial > repos > fgiacomoni > downloader_bank_hmdb
changeset 2:be504ccbc41c draft default tip
master branch Updating with tag :CI_COMMIT_TAG - - Fxx
| author | fgiacomoni |
|---|---|
| date | Wed, 30 Nov 2022 16:14:27 +0000 |
| parents | 4373f936111d |
| children | |
| files | Dockerfile LICENSE README README.md conf.cfg downloader_bank_hmdb.pl downloader_bank_hmdb.xml lib/conf.pm lib/csv.pm lib/hmdb_api.pm lib/utils.pm t/downloader_bank_hmdb.t t/lib/hmdb_apiTest.pm t/lib/utilsTest.pm test-data/out01.tabular test-data/out02.tabular test-data/out03.tabular test-data/out04.tabular test-data/out05.tabular |
| diffstat | 11 files changed, 213 insertions(+), 10610 deletions(-) [+] |
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--- a/Dockerfile Tue Jan 21 16:09:45 2020 -0500 +++ b/Dockerfile Wed Nov 30 16:14:27 2022 +0000 @@ -1,51 +1,41 @@ -FROM ubuntu:18.04 +#FROM pfem/perlfull +FROM python:3.8-buster # set author -MAINTAINER Franck Giacomoni <franck.giacomoni.fr> +LABEL maintainer="franck.giacomoni@inrae.fr" -### -### [CONTAINER CORE FUNCTIONS]: -### xxxx -### xxxx -### [NOTES] -### xxxx +ENV PLANEMO_VENV_LOCATION /planemo-venv +ENV CONDA /tmp/conda -ENV PATH /opt/conda/bin:$PATH -RUN apt-get -y update &&\ - apt-get -y install build-essential \ - cpanminus \ - gzip \ - wget \ - bzip2 \ - ca-certificates \ - libglib2.0-0 \ - libxext6 \ - libsm6 \ - libxrender1 \ - libtext-csv-perl \ - libxml-twig-perl \ - libfile-share-perl - -RUN wget --quiet https://repo.anaconda.com/archive/Anaconda3-5.3.0-Linux-x86_64.sh -O ~/anaconda.sh && \ - /bin/bash ~/anaconda.sh -b -p /opt/conda && \ - rm ~/anaconda.sh && \ - ln -s /opt/conda/etc/profile.d/conda.sh /etc/profile.d/conda.sh && \ - echo ". /opt/conda/etc/profile.d/conda.sh" >> ~/.bashrc && \ - echo "conda activate base" >> ~/.bashrc - -RUN cpan install ExtUtils::MakeMaker && \ - cpan install File::ShareDir::Install && \ - cpan install Module::Release &&\ - cpan install Archive::Zip &&\ - - apt -y install git &&\ - apt -y install python2.7 python-pip &&\ - apt -y install virtualenv &&\ - pip install "pip>=7" &&\ - pip install -U git+git://github.com/galaxyproject/planemo.git &&\ - +RUN apt-get update &&\ + apt-get upgrade -y &&\ + apt-get install --no-install-recommends --yes build-essential \ + git \ + libgl1-mesa-glx \ + libegl1-mesa \ + libxrandr2 \ + libxss1 \ + libxcursor1 \ + libxcomposite1 \ + libasound2 \ + libxi6 \ + libxtst6 \ +# python3 \ +# python3-pip \ + python-virtualenv && \ + pip install virtualenv && \ + python3 -m virtualenv "$PLANEMO_VENV_LOCATION" && \ + . "$PLANEMO_VENV_LOCATION"/bin/activate && \ + pip install --upgrade pip setuptools && \ + pip install planemo numpy && \ + pip install -U planemo && \ + #planemo conda_init --conda_prefix "$CONDA" && \ apt-get autoremove -y && \ apt-get clean && \ - rm -rf /var/lib/apt/lists/* /tmp/* /var/tmp/* - + rm -rf /var/lib/apt/lists/* && \ + rm -rf /tmp/* && \ + rm -rf /var/tmp/* && \ + rm -rf /usr/bin/X11 ; + +CMD [] \ No newline at end of file
--- a/conf.cfg Tue Jan 21 16:09:45 2020 -0500 +++ b/conf.cfg Wed Nov 30 16:14:27 2022 +0000 @@ -4,6 +4,7 @@ VERSION=1.1 ##v1.0 : Init ##V1.1 : calculating and adding [M+H]+ and [M-H]- mono isotopic mass in banks +##V1.1.1 : Links updating # ## ARGVT PROTON_MASS=1.007825 @@ -15,44 +16,54 @@ #HMDB archive url HMDB_URL= -## Serum -SERUM_URL=http://www.hmdb.ca/system/downloads/current/serum_metabolites.zip +## Sweat - added 22/11/28 +SWEAT_URL=https://hmdb.ca/system/downloads/current/sweat_metabolites.zip +SWEAT_FILE_NAME=sweat_metabolites.xml +SWEAT_HTTP_FORMAT=ZIP +SWEAT_DB_FORMAT=XML +## Serum - updated 22/11/28 +SERUM_URL=https://hmdb.ca/system/downloads/current/serum_metabolites.zip SERUM_FILE_NAME=serum_metabolites.xml SERUM_HTTP_FORMAT=ZIP SERUM_DB_FORMAT=XML -## Urine -URINE_URL=http://www.hmdb.ca/system/downloads/current/urine_metabolites.zip +## Urine - updated 22/11/28 +URINE_URL=https://hmdb.ca/system/downloads/current/urine_metabolites.zip URINE_FILE_NAME=urine_metabolites.xml URINE_HTTP_FORMAT=ZIP URINE_DB_FORMAT=XML ## Other matrices: -## CSF -CSF_URL=http://www.hmdb.ca/system/downloads/current/csf_metabolites.zip +## CSF - updated 22/11/28 +CSF_URL=https://hmdb.ca/system/downloads/current/csf_metabolites.zip CSF_FILE_NAME=csf_metabolites.xml CSF_HTTP_FORMAT=ZIP CSF_DB_FORMAT=XML -##FECES -FECES_URL=http://www.fecalmetabolome.ca/system/downloads/current/feces_metabolites.zip +##FECES - updated 22/11/28 +FECES_URL=https://hmdb.ca/system/downloads/current/feces_metabolites.zip FECES_FILE_NAME=feces_metabolites.xml FECES_HTTP_FORMAT=ZIP FECES_DB_FORMAT=XML -##SALIVA -SALIVA_URL=http://www.salivametabolome.ca/system/downloads/current/saliva_metabolites.zip +##SALIVA - updated 22/11/28 +SALIVA_URL=https://hmdb.ca/system/downloads/current/saliva_metabolites.zip SALIVA_FILE_NAME=saliva_metabolites.xml SALIVA_HTTP_FORMAT=ZIP SALIVA_DB_FORMAT=XML -##RUMEN -RUMEN_URL=http://www.rumendb.ca/public/downloads/current/metabocards.gz -RUMEN_FILE_NAME=metabocards -RUMEN_HTTP_FORMAT=GZ -RUMEN_DB_FORMAT=CARD -##COW -COW_URL=http://www.cowmetdb.ca/public/downloads/current/metabocards.gz -COW_FILE_NAME=metabocards -COW_HTTP_FORMAT=GZ -COW_DB_FORMAT=CARD -##MILK -MILK_URL=http://www.mcdb.ca/system/downloads/current/milk_metabolites.zip +##RUMEN - updated 22/11/28 +#RUMEN_URL=https://www.rumendb.ca/public/downloads/current/metabocards.gz +#RUMEN_FILE_NAME=metabocards +#RUMEN_HTTP_FORMAT=GZ +#RUMEN_DB_FORMAT=CARD +##COW - updated 22/11/28 +COW_URL=https://www.bovinedb.ca/system/downloads/current/bmdb_metabolites.zip +COW_FILE_NAME=bmdb_metabolites.xml +COW_HTTP_FORMAT=ZIP +COW_DB_FORMAT=XML +##MILK - updated 22/11/28 +MILK_URL=https://mcdb.ca/system/downloads/current/milk_metabolites.zip MILK_FILE_NAME=milk_metabolites.xml MILK_HTTP_FORMAT=ZIP -MILK_DB_FORMAT=XML \ No newline at end of file +MILK_DB_FORMAT=XML +##T3DB +TOXIN_URL=http://www.t3db.ca/system/downloads/current/toxins.xml.zip +TOXIN_FILE_NAME=toxins.xml +TOXIN_HTTP_FORMAT=ZIP +TOXIN_DB_FORMAT=XML \ No newline at end of file
--- a/downloader_bank_hmdb.pl Tue Jan 21 16:09:45 2020 -0500 +++ b/downloader_bank_hmdb.pl Wed Nov 30 16:14:27 2022 +0000 @@ -71,6 +71,7 @@ $bankUrl = $CONF->{$bankName.'_URL'} ; # get version of the http resource my $oUtils = utils->new() ; + $oUtils->checkHttpUrl($bankUrl) ; ($bankVersion) = $oUtils->getHttpFileVersion($bankUrl) ; print "\tThe current version is: $bankVersion\n" if $VERBOSE > 1 ; @@ -132,7 +133,15 @@ print "\tDownload of the asked bank ($bankName)...\n" if $VERBOSE > 1 ; print "\tFrom...$bankUrl\n" if $VERBOSE > 1 ; my $oDownloader = utils->new() ; - my ($fileZip) = $oDownloader->getHttpFile($bankUrl, $bankFilePath) ; + my ($httpStatus) = $oDownloader->getHttpFile($bankUrl, $bankFilePath) ; + + if ($httpStatus ne '200 OK' ) { + unlink $bankFileDir ; + croak "\t/!\\ Download of $bankUrl failed with HTTP error: $httpStatus\n" ; + } + else { + print "\tDownloading process ended with HTTP: $httpStatus\n" ; + } print "\tUnzip the download archive ($bankFilePath) and clean env ...\n" if $VERBOSE > 1 ;
--- a/downloader_bank_hmdb.xml Tue Jan 21 16:09:45 2020 -0500 +++ b/downloader_bank_hmdb.xml Wed Nov 30 16:14:27 2022 +0000 @@ -1,12 +1,13 @@ -<tool id="downloader_bank_hmdb" name="HMDB bank downloader" version="2018.12"> +<tool id="downloader_bank_hmdb" name="Wishart bank downloader" version="1.1.2"> <description> - : get a specific metabolite bank (as Urine...) from HMDB web portal. + : get a specific metabolite bank (as Urine, Serum...) from Wishart web portal. </description> <requirements> <requirement type="package" version="2.161">perl-data-dumper</requirement> <requirement type="package" version="6.15">perl-lwp-simple</requirement> <requirement type="package" version="6.15">perl-libwww-perl</requirement> + <requirement type="package" version="6.07">perl-lwp-protocol-https</requirement> <requirement type="package" version="1.74">perl-uri</requirement> <requirement type="package" version="1.97">perl-text-csv</requirement> <requirement type="package" version="3.52">perl-xml-twig</requirement> @@ -28,15 +29,16 @@ ]]></command> <inputs> - <param name="bank" type="select" label="What is the specific bank you want to download? " help="All banks are extracted from downloads section on HMDB web portal."> + <param name="bank" type="select" label="What is the specific bank you want to download? " help="All banks are extracted from downloads section on Whishart web portals."> <option value="SERUM" selected="true">Human serum</option> <option value="URINE">Human urine</option> + <option value="SWEAT">Human sweat</option> <option value="CSF">Human cerebrospinal fluid</option> <option value="FECES">Human feces</option> <option value="SALIVA">Human saliva</option> <option value="COW">Bovine</option> - <option value="RUMEN">Bovine rumen</option> <option value="MILK">Bovine milk</option> + <option value="TOXIC">Toxin and Toxin Target Database</option> </param> <param name="bankformat" type="select" label="Which output format do you need? " help="Proposed formats are lighter than downloaded raw files and adapted to annotation tools."> <option value="tabular" selected="true">tabular (for BiH tool)</option> @@ -67,14 +69,14 @@ .. class:: infomark -**Authors** Charlotte Joly, Delphine Centeno and Franck Giacomoni +**Authors** Charlotte Joly, Delphine Centeno, Lain Pavot, Yann Guitton and Franck Giacomoni --------------------------------------------------- .. class:: infomark **Please cite** If you use this tool, please add the following reference - | Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, et al., HMDB 4.0 — The Human Metabolome Database for 2018. Nucleic Acids Res. 2018. Jan 4;46(D1):D608-17. + | Wishart DS, Guo AC, Oler E, et al., HMDB 5.0: the Human Metabolome Database for 2022. Nucleic Acids Res. 2022. Jan 7;50(D1):D622–31. --------------------------------------------------- @@ -128,8 +130,6 @@ Two types of files | REF_HMDB_BANKNAME.tabular: for W4M BiH annotation tool as example - | - | REF_HMDB_BANKNAME.json: for linking with others modules. | --------------------------------------------------- @@ -148,7 +148,7 @@ .. class:: warningmark -And their "W4M courses 2018": +And their "W4M courses 2020": | Using Galaxy4Metabolomics - W4M table format for Galaxy | Annotation Banks - Annotation @@ -157,5 +157,7 @@ <!-- [RECOMMANDED] All citations associated to this tool (main citation given above and other references). Can be extracted from the history panel --> <citations> <citation type="doi">10.1093/nar/gkx1089</citation> + <citation type="doi">10.1093/nar/gku1004</citation> + <citation type="doi">10.1093/nar/gkab1062</citation> </citations> </tool> \ No newline at end of file
--- a/lib/hmdb_api.pm Tue Jan 21 16:09:45 2020 -0500 +++ b/lib/hmdb_api.pm Wed Nov 30 16:14:27 2022 +0000 @@ -214,7 +214,7 @@ $metabolites->{$id}{'[M-H]-'} = ( $tmp_mass - $proton_mass + $electron_mass) * $charge ; } else { - warn "No monisotopic_molecular_weight field exists with metabolite $id\n " ; + warn "No monoisotopic_molecular_weight field exists with metabolite $id - this entry is not added in dumped file\n " ; } } } @@ -226,7 +226,7 @@ $entry->{'MZ_[M-H]-'} = ( $tmp_mass - $proton_mass + $electron_mass) * $charge ; } else { - warn "No MZ_MONO field exists with metabolite $entry->{'HMDB_ID'}\n " ; + warn "No MZ_MONO field exists with metabolite $entry->{'HMDB_ID'} - this entry is not added in dumped file\n " ; } } } @@ -270,7 +270,11 @@ push (@tmp, $metabolites->{$id}{'inchikey'}) ; # merge - push (@metabolitesSorted, \@tmp) ; + + ## filter entry if no monisotopic_molecular_weight is present + if ($metabolites->{$id}{'monisotopic_molecular_weight'} ne '') { + push (@metabolitesSorted, \@tmp) ; + } } return (\@metabolitesSorted) ;
--- a/lib/utils.pm Tue Jan 21 16:09:45 2020 -0500 +++ b/lib/utils.pm Wed Nov 30 16:14:27 2022 +0000 @@ -56,6 +56,37 @@ } ### END of SUB +=head2 METHOD checkHttpUrl + + ## Description : check if a http url exists or not and warn/die + ## Input : $url + ## Output : $warn + ## Usage : my ( $warn ) = checkHttpUrl ( $url ) ; + +=cut +## START of SUB +sub checkHttpUrl { + ## Retrieve Values + my $self = shift ; + my ( $url ) = @_; + my ( $warn ) = ( undef ) ; + + my $ua = new LWP::UserAgent; + + ## just make different not existing/time out + $ua->timeout(10); + + if ($ua->head($url)) { + print "\t$url DOES EXIST\n"; + } else { + croak "\t$url DOES not exist or timeout\n";; + } + + + return ($warn) ; +} +### END of SUB + =head2 METHOD getHttpFileVersion ## Description : fetch the version of a file from its http header @@ -74,11 +105,15 @@ # based on https://stackoverflow.com/questions/36903905/extract-headers-from-http-request-in-perl my $ua = new LWP::UserAgent; + $ua->agent("Mozilla/5.0 (Macintosh; Intel Mac OS X 10.11; rv:64.0) Gecko/20100101 Firefox/64.0"); + $ua->from('franck.giacomoni@inrae.fr'); + $ua->ssl_opts(timeout => 100, verify_hostname => 0); + my $result = $ua->head($url); for my $header_name ($result->header_field_names) { - if ($header_name eq 'Last-Modified') { + if ( ($header_name eq 'Last-Modified') or ($header_name eq 'last-Modified') or ($header_name eq 'last-Modified') ) { # print $result->header($header_name)."\n"; if ($result->header($header_name) =~/[a-z|A-Z]+,\s(.*)\s[0-9]+:[0-9]+:[0-9]+\s[a-z|A-Z]+$/) { $version = $1 ; @@ -95,9 +130,13 @@ else { next ; } -# print $version ; +# print "\tVERSION IS: $version\n" ; } - + + if (!$version) { + croak "\t /!\\ the current version of the db is not findable !!" + } + return($version) ; } ## END of SUB @@ -116,22 +155,41 @@ my $self = shift ; my ( $url, $fileNameToGet ) = @_ ; - my ( $fileName ) = undef ; + my $hstatus = 404 ; # default if ( (defined $url ) and (defined $fileNameToGet ) ) { my $ua = LWP::UserAgent->new(); - my $hstatus = getstore ($url, $fileNameToGet); + $ua->agent("Mozilla/5.0 (Macintosh; Intel Mac OS X 10.11; rv:64.0) Gecko/20100101 Firefox/64.0"); + $ua->from('franck.giacomoni@inrae.fr'); + $ua->ssl_opts(timeout => 100, verify_hostname => 0); + +# my $hstatus = getstore ($url, $fileNameToGet); + + my $response = $ua->get($url); + + if ($response->is_error) { + $hstatus = $response->status_line ; + print "\t\t$hstatus: ", status_message($hstatus), "\n"; + carp $response->status_line, "\n"; + } + else { + $hstatus = $response->status_line ; + } + + open my $fh, '>', $fileNameToGet or die $!; + binmode $fh; + print $fh $response->decoded_content; - if($hstatus != HTTP_OK) { - print "$hstatus: ", status_message($hstatus), "\n"; - } - +# if($hstatus != HTTP_OK) { +# print "\t\t$hstatus: ", status_message($hstatus), "\n"; +# } +# if (!-e $fileNameToGet) { - croak "None file (should be $fileNameToGet) was download from the given url($url)\n" ; + carp "None file (should be $fileNameToGet) was download from the given url($url)\n" ; } } - return(1) ; + return($hstatus) ; } ## END of SUB
--- a/test-data/out01.tabular Tue Jan 21 16:09:45 2020 -0500 +++ b/test-data/out01.tabular Wed Nov 30 16:14:27 2022 +0000 @@ -1,8 +1,8 @@ HMDB_ID MzBank [M+H]+ [M-H]- MetName ChemFormula INChIkey HMDB0000001 169.085126611 170.092403011 168.077850211 1-Methylhistidine C7H11N3O2 BRMWTNUJHUMWMS-LURJTMIESA-N HMDB0000005 102.031694058 103.038970458 101.024417658 "2-Ketobutyric acid" C4H6O3 TYEYBOSBBBHJIV-UHFFFAOYSA-N -HMDB0000008 104.047344122 105.054620522 103.040067722 "2-Hydroxybutyric acid" C4H8O3 AFENDNXGAFYKQO-UHFFFAOYSA-N -HMDB0000011 104.047344122 105.054620522 103.040067722 "(R)-3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-GSVOUGTGSA-N +HMDB0000008 104.047344118 105.054620518 103.040067718 "2-Hydroxybutyric acid" C4H8O3 AFENDNXGAFYKQO-VKHMYHEASA-N +HMDB0000011 104.047344122 105.054620522 103.040067722 "3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-GSVOUGTGSA-N HMDB0000012 228.074621504 229.081897904 227.067345104 Deoxyuridine C9H12N2O5 MXHRCPNRJAMMIM-SHYZEUOFSA-N HMDB0000017 183.053157781 184.060434181 182.045881381 "4-Pyridoxic acid" C8H9NO4 HXACOUQIXZGNBF-UHFFFAOYSA-N HMDB0000019 116.047344122 117.054620522 115.040067722 "alpha-Ketoisovaleric acid" C5H8O3 QHKABHOOEWYVLI-UHFFFAOYSA-N @@ -10,12 +10,12 @@ HMDB0000022 167.094628665 168.101905065 166.087352265 3-Methoxytyramine C9H13NO2 DIVQKHQLANKJQO-UHFFFAOYSA-N HMDB0000023 104.047344122 105.054620522 103.040067722 "(S)-3-Hydroxyisobutyric acid" C4H8O3 DBXBTMSZEOQQDU-VKHMYHEASA-N HMDB0000026 132.053492132 133.060768532 131.046215732 "Ureidopropionic acid" C4H8N2O3 JSJWCHRYRHKBBW-UHFFFAOYSA-N -HMDB0000027 241.117489371 242.124765771 240.110212971 Tetrahydrobiopterin C9H15N5O3 FNKQXYHWGSIFBK-UHFFFAOYSA-N +HMDB0000027 241.117489371 242.124765771 240.110212971 Tetrahydrobiopterin C9H15N5O3 FNKQXYHWGSIFBK-RPDRRWSUSA-N HMDB0000030 244.088163078 245.095439478 243.080886678 Biotin C10H16N2O3S YBJHBAHKTGYVGT-ZKWXMUAHSA-N HMDB0000031 290.224580204 291.231856604 289.217303804 Androsterone C19H30O2 QGXBDMJGAMFCBF-HLUDHZFRSA-N HMDB0000032 384.33921603 385.34649243 383.33193963 7-Dehydrocholesterol C27H44O UCTLRSWJYQTBFZ-DDPQNLDTSA-N HMDB0000034 135.054495185 136.061771585 134.047218785 Adenine C5H5N5 GFFGJBXGBJISGV-UHFFFAOYSA-N -HMDB0000038 239.101839307 240.109115707 238.094562907 Dihydrobiopterin C9H13N5O3 FEMXZDUTFRTWPE-UHFFFAOYSA-N +HMDB0000038 239.101839307 240.109115707 238.094562907 Dihydrobiopterin C9H13N5O3 FEMXZDUTFRTWPE-DZSWIPIPSA-N HMDB0000039 88.0524295 89.0597059 87.0451531 "Butyric acid" C4H8O2 FERIUCNNQQJTOY-UHFFFAOYSA-N HMDB0000042 60.021129372 61.028405772 59.013852972 "Acetic acid" C2H4O2 QTBSBXVTEAMEQO-UHFFFAOYSA-N HMDB0000044 176.032087988 177.039364388 175.024811588 "Ascorbic acid" C6H8O6 CIWBSHSKHKDKBQ-JLAZNSOCSA-N @@ -27,7 +27,7 @@ HMDB0000056 89.047678473 90.054954873 88.040402073 beta-Alanine C3H7NO2 UCMIRNVEIXFBKS-UHFFFAOYSA-N HMDB0000058 329.052519653 330.059796053 328.045243253 "Cyclic AMP" C10H12N5O6P IVOMOUWHDPKRLL-KQYNXXCUSA-N HMDB0000060 102.031694058 103.038970458 101.024417658 "Acetoacetic acid" C4H6O3 WDJHALXBUFZDSR-UHFFFAOYSA-N -HMDB0000062 161.105193351 162.112469751 160.097916951 L-Carnitine C7H15NO3 PHIQHXFUZVPYII-ZCFIWIBFSA-N +HMDB0000062 162.113018383 163.120294783 161.105741983 L-Carnitine C7H16NO3 PHIQHXFUZVPYII-ZCFIWIBFSA-O HMDB0000063 362.20932407 363.21660047 361.20204767 Cortisol C21H30O5 JYGXADMDTFJGBT-VWUMJDOOSA-N HMDB0000064 131.069476547 132.076752947 130.062200147 Creatine C4H9N3O2 CVSVTCORWBXHQV-UHFFFAOYSA-N HMDB0000067 386.354866094 387.362142494 385.347589694 Cholesterol C27H46O HVYWMOMLDIMFJA-DPAQBDIFSA-N @@ -38,8 +38,8 @@ HMDB0000076 114.042927446 115.050203846 113.035651046 Dihydrouracil C4H6N2O2 OIVLITBTBDPEFK-UHFFFAOYSA-N HMDB0000077 288.20893014 289.21620654 287.20165374 Dehydroepiandrosterone C19H28O2 FMGSKLZLMKYGDP-USOAJAOKSA-N HMDB0000078 178.041212886 179.048489286 177.033936486 Cysteinylglycine C5H10N2O3S ZUKPVRWZDMRIEO-VKHMYHEASA-N -HMDB0000079 128.05857751 129.06585391 127.05130111 Dihydrothymine C5H8N2O2 NBAKTGXDIBVZOO-UHFFFAOYSA-N -HMDB0000086 257.102823889 258.110100289 256.095547489 Glycerophosphocholine C8H20NO6P SUHOQUVVVLNYQR-QMMMGPOBSA-N +HMDB0000079 128.058577506 129.065853906 127.051301106 Dihydrothymine C5H8N2O2 NBAKTGXDIBVZOO-VKHMYHEASA-N +HMDB0000086 257.102824366 258.110100766 256.095547966 Glycerophosphocholine C8H20NO6P SUHOQUVVVLNYQR-MRVPVSSYSA-N HMDB0000087 45.057849229 46.065125629 44.050572829 Dimethylamine C2H7N ROSDSFDQCJNGOL-UHFFFAOYSA-N HMDB0000089 243.085520541 244.092796941 242.078244141 Cytidine C9H13N3O5 UHDGCWIWMRVCDJ-XVFCMESISA-N HMDB0000094 192.02700261 193.03427901 191.01972621 "Citric acid" C6H8O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N @@ -52,7 +52,7 @@ HMDB0000118 182.057908808 183.065185208 181.050632408 "Homovanillic acid" C9H10O4 QRMZSPFSDQBLIX-UHFFFAOYSA-N HMDB0000119 74.00039393 75.00767033 72.99311753 "Glyoxylic acid" C2H2O3 HHLFWLYXYJOTON-UHFFFAOYSA-N HMDB0000121 441.139681375 442.146957775 440.132404975 "Folic acid" C19H19N7O6 OVBPIULPVIDEAO-LBPRGKRZSA-N -HMDB0000122 180.063388116 181.070664516 179.056111716 D-Glucose C6H12O6 WQZGKKKJIJFFOK-GASJEMHNSA-N +HMDB0000122 180.063388116 181.070664516 179.056111716 D-Glucose C6H12O6 WQZGKKKJIJFFOK-VFUOTHLCSA-N HMDB0000123 75.032028409 76.039304809 74.024752009 Glycine C2H5NO2 DHMQDGOQFOQNFH-UHFFFAOYSA-N HMDB0000125 307.083805981 308.091082381 306.076529581 Glutathione C10H17N3O6S RWSXRVCMGQZWBV-WDSKDSINSA-N HMDB0000128 117.053826483 118.061102883 116.046550083 "Guanidoacetic acid" C3H7N3O2 BPMFZUMJYQTVII-UHFFFAOYSA-N @@ -64,7 +64,7 @@ HMDB0000148 147.053157781 148.060434181 146.045881381 "L-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-VKHMYHEASA-N HMDB0000149 61.052763851 62.060040251 60.045487451 Ethanolamine C2H7NO HZAXFHJVJLSVMW-UHFFFAOYSA-N HMDB0000151 272.177630012 273.184906412 271.170353612 Estradiol C18H24O2 VOXZDWNPVJITMN-ZBRFXRBCSA-N -HMDB0000156 134.021523302 135.028799702 133.014246902 "L-Malic acid" C4H6O5 BJEPYKJPYRNKOW-REOHCLBHSA-N +HMDB0000156 134.021523302 135.028799702 133.014246902 "Malic acid" C4H6O5 BJEPYKJPYRNKOW-REOHCLBHSA-N HMDB0000157 136.03851077 137.04578717 135.03123437 Hypoxanthine C5H4N4O FDGQSTZJBFJUBT-UHFFFAOYSA-N HMDB0000158 181.073893223 182.081169623 180.066616823 L-Tyrosine C9H11NO3 OUYCCCASQSFEME-QMMMGPOBSA-N HMDB0000159 165.078978601 166.086255001 164.071702201 L-Phenylalanine C9H11NO2 COLNVLDHVKWLRT-QMMMGPOBSA-N @@ -72,7 +72,7 @@ HMDB0000162 115.063328537 116.070604937 114.056052137 L-Proline C5H9NO2 ONIBWKKTOPOVIA-BYPYZUCNSA-N HMDB0000167 119.058243159 120.065519559 118.050966759 L-Threonine C4H9NO3 AYFVYJQAPQTCCC-GBXIJSLDSA-N HMDB0000168 132.053492132 133.060768532 131.046215732 L-Asparagine C4H8N2O3 DCXYFEDJOCDNAF-REOHCLBHSA-N -HMDB0000169 180.063388116 181.070664516 179.056111716 D-Mannose C6H12O6 WQZGKKKJIJFFOK-QTVWNMPRSA-N +HMDB0000169 180.063388116 181.070664516 179.056111716 D-Mannose C6H12O6 WQZGKKKJIJFFOK-PQMKYFCFSA-N HMDB0000172 131.094628665 132.101905065 130.087352265 L-Isoleucine C6H13NO2 AGPKZVBTJJNPAG-WHFBIAKZSA-N HMDB0000175 348.047099924 349.054376324 347.039823524 "Inosinic acid" C10H13N4O8P GRSZFWQUAKGDAV-KQYNXXCUSA-N HMDB0000177 155.069476547 156.076752947 154.062200147 L-Histidine C6H9N3O2 HNDVDQJCIGZPNO-YFKPBYRVSA-N @@ -85,7 +85,7 @@ HMDB0000193 192.02700261 193.03427901 191.01972621 "Isocitric acid" C6H8O7 ODBLHEXUDAPZAU-UHFFFAOYSA-N HMDB0000195 268.080769514 269.088045914 267.073493114 Inosine C10H12N4O5 UGQMRVRMYYASKQ-KQYNXXCUSA-N HMDB0000197 175.063328537 176.070604937 174.056052137 "Indoleacetic acid" C10H9NO2 SEOVTRFCIGRIMH-UHFFFAOYSA-N -HMDB0000201 203.115758031 204.123034431 202.108481631 L-Acetylcarnitine C9H17NO4 RDHQFKQIGNGIED-MRVPVSSYSA-N +HMDB0000201 204.123583069 205.130859469 203.116306669 L-Acetylcarnitine C9H18NO4 RDHQFKQIGNGIED-MRVPVSSYSA-O HMDB0000202 118.02660868 119.03388508 117.01933228 "Methylmalonic acid" C4H6O4 ZIYVHBGGAOATLY-UHFFFAOYSA-N HMDB0000207 282.255880332 283.263156732 281.248603932 "Oleic acid" C18H34O2 ZQPPMHVWECSIRJ-KTKRTIGZSA-N HMDB0000208 146.021523302 147.028799702 145.014246902 "Oxoglutaric acid" C5H6O5 KPGXRSRHYNQIFN-UHFFFAOYSA-N @@ -126,7 +126,6 @@ HMDB0000318 170.057908808 171.065185208 169.050632408 3,4-Dihydroxyphenylglycol C8H10O4 MTVWFVDWRVYDOR-UHFFFAOYSA-N HMDB0000336 104.047344122 105.054620522 103.040067722 "(R)-3-Hydroxyisobutyric acid" C4H8O3 DBXBTMSZEOQQDU-GSVOUGTGSA-N HMDB0000337 120.042258744 121.049535144 119.034982344 "(S)-3,4-Dihydroxybutyric acid" C4H8O4 DZAIOXUZHHTJKN-UHFFFAOYSA-N -HMDB0000357 104.047344122 105.054620522 103.040067722 "3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-UHFFFAOYSA-N HMDB0000360 120.042258744 121.049535144 119.034982344 "2,4-Dihydroxybutanoic acid" C4H8O4 UFYGCFHQAXXBCF-UHFFFAOYSA-N HMDB0000379 206.042652674 207.049929074 205.035376274 "2-Methylcitric acid" C7H10O7 YNOXCRMFGMSKIJ-UHFFFAOYSA-N HMDB0000407 118.062994186 119.070270586 117.055717786 "2-Hydroxy-3-methylbutyric acid" C5H10O3 NGEWQZIDQIYUNV-UHFFFAOYSA-N @@ -141,7 +140,7 @@ HMDB0000472 220.08479226 221.09206866 219.07751586 5-Hydroxy-L-tryptophan C11H12N2O3 LDCYZAJDBXYCGN-VIFPVBQESA-N HMDB0000479 169.085126611 170.092403011 168.077850211 3-Methylhistidine C7H11N3O2 JDHILDINMRGULE-LURJTMIESA-N HMDB0000482 144.115029756 145.122306156 143.107753356 "Caprylic acid" C8H16O2 WWZKQHOCKIZLMA-UHFFFAOYSA-N -HMDB0000491 130.062994186 131.070270586 129.055717786 "3-Methyl-2-oxovaleric acid" C6H10O3 JVQYSWDUAOAHFM-UHFFFAOYSA-N +HMDB0000491 130.062994186 131.070270586 129.055717786 "3-Methyl-2-oxovaleric acid" C6H10O3 JVQYSWDUAOAHFM-BYPYZUCNSA-N HMDB0000492 34.968852707 35.976129107 33.961576307 "Chloride ion" Cl VEXZGXHMUGYJMC-UHFFFAOYSA-M HMDB0000500 138.031694053 139.038970453 137.024417653 "4-Hydroxybenzoic acid" C7H6O3 FJKROLUGYXJWQN-UHFFFAOYSA-N HMDB0000501 400.334130652 401.341407052 399.326854252 7-Ketocholesterol C27H44O2 YIKKMWSQVKJCOP-QJFKPLHKSA-N @@ -167,7 +166,7 @@ HMDB0000622 132.042258744 133.049535144 131.034982344 "Ethylmalonic acid" C5H8O4 UKFXDFUAPNAMPJ-UHFFFAOYSA-N HMDB0000638 200.177630012 201.184906412 199.170353612 "Dodecanoic acid" C12H24O2 POULHZVOKOAJMA-UHFFFAOYSA-N HMDB0000641 146.069142196 147.076418596 145.061865796 L-Glutamine C5H10N2O3 ZDXPYRJPNDTMRX-VKHMYHEASA-N -HMDB0000646 150.05282343 151.06009983 149.04554703 L-Arabinose C5H10O5 SRBFZHDQGSBBOR-HWQSCIPKSA-N +HMDB0000646 150.05282343 151.06009983 149.04554703 L-Arabinose C5H10O5 SRBFZHDQGSBBOR-KLVWXMOXSA-N HMDB0000657 62.929601079 63.936877479 61.922324679 Copper Cu JPVYNHNXODAKFH-UHFFFAOYSA-N HMDB0000660 180.063388116 181.070664516 179.056111716 D-Fructose C6H12O6 RFSUNEUAIZKAJO-ARQDHWQXSA-N HMDB0000661 132.042258744 133.049535144 131.034982344 "Glutaric acid" C5H8O4 JFCQEDHGNNZCLN-UHFFFAOYSA-N @@ -187,24 +186,22 @@ HMDB0000714 179.058243159 180.065519559 178.050966759 "Hippuric acid" C9H9NO3 QIAFMBKCNZACKA-UHFFFAOYSA-N HMDB0000715 189.042593095 190.049869495 188.035316695 "Kynurenic acid" C10H7NO3 HCZHHEIFKROPDY-UHFFFAOYSA-N HMDB0000718 102.068079564 103.075355964 101.060803164 "Isovaleric acid" C5H10O2 GWYFCOCPABKNJV-UHFFFAOYSA-N -HMDB0000721 172.08479226 173.09206866 171.07751586 Glycylproline C7H12N2O3 KZNQNBZMBZJQJO-UHFFFAOYSA-N +HMDB0000721 172.08479226 173.09206866 171.07751586 Glycylproline C7H12N2O3 KZNQNBZMBZJQJO-YFKPBYRVSA-N HMDB0000725 131.058243159 132.065519559 130.050966759 4-Hydroxyproline C5H9NO3 PMMYEEVYMWASQN-DMTCNVIQSA-N -HMDB0000742 135.035399227 136.042675627 134.028122827 Homocysteine C4H9NO2S FFFHZYDWPBMWHY-UHFFFAOYSA-N -HMDB0000744 134.021523302 135.028799702 133.014246902 "Malic acid" C4H6O5 BJEPYKJPYRNKOW-UHFFFAOYSA-N +HMDB0000742 135.035399227 136.042675627 134.028122827 Homocysteine C4H9NO2S FFFHZYDWPBMWHY-VKHMYHEASA-N HMDB0000745 240.122240398 241.129516798 239.114963998 Homocarnosine C10H16N4O3 CCLQKVKJOGVQLU-QMMMGPOBSA-N HMDB0000746 132.07864425 133.08592065 131.07136785 "Hydroxyisocaproic acid" C6H12O3 LVRFTAZAXQPQHI-YFKPBYRVSA-N -HMDB0000751 150.05282343 151.06009983 149.04554703 L-Threo-2-pentulose C5H10O5 ZAQJHHRNXZUBTE-WVZVXSGGSA-N +HMDB0000751 150.052823422 151.060099822 149.045547022 L-Xylulose C5H10O5 LQXVFWRQNMEDEE-LMVFSUKVSA-N HMDB0000754 118.062994186 119.070270586 117.055717786 "3-Hydroxyisovaleric acid" C5H10O3 AXFYFNCPONWUHW-UHFFFAOYSA-N HMDB0000755 182.057908808 183.065185208 181.050632408 "Hydroxyphenyllactic acid" C9H10O4 JVGVDSSUAVXRDY-UHFFFAOYSA-N HMDB0000763 191.058243159 192.065519559 190.050966759 "5-Hydroxyindoleacetic acid" C10H9NO3 DUUGKQCEGZLZNO-UHFFFAOYSA-N HMDB0000765 182.07903818 183.08631458 181.07176178 Mannitol C6H14O6 FBPFZTCFMRRESA-KVTDHHQDSA-N HMDB0000784 188.104859 189.1121354 187.0975826 "Azelaic acid" C9H16O4 BDJRBEYXGGNYIS-UHFFFAOYSA-N -HMDB0000787 241.117489371 242.124765771 240.110212971 Sapropterin C9H15N5O3 FNKQXYHWGSIFBK-BYAPIUGTSA-N HMDB0000797 454.073708604 455.080985004 453.066432204 SAICAR C13H19N4O12P NAQGHJTUZRHGAC-ZZZDFHIKSA-N HMDB0000806 228.20893014 229.21620654 227.20165374 "Myristic acid" C14H28O2 TUNFSRHWOTWDNC-UHFFFAOYSA-N HMDB0000812 175.048072403 176.055348803 174.040796003 "N-Acetyl-L-aspartic acid" C6H9NO5 OTCCIMWXFLJLIA-BYPYZUCNSA-N HMDB0000819 183.089543287 184.096819687 182.082266887 Normetanephrine C9H13NO3 YNYAYWLBAHXHLL-UHFFFAOYSA-N -HMDB0000824 217.131408101 218.138684501 216.124131701 Propionylcarnitine C10H19NO4 UFAHZIUFPNSHSL-UHFFFAOYSA-N +HMDB0000824 218.138684548 219.145960948 217.131408148 Propionylcarnitine C10H20NO4 UFAHZIUFPNSHSL-MRVPVSSYSA-O HMDB0000827 284.271530396 285.278806796 283.264253996 "Stearic acid" C18H36O2 QIQXTHQIDYTFRH-UHFFFAOYSA-N HMDB0000830 267.095416525 268.102692925 266.088140125 "Neuraminic acid" C9H17NO8 CERZMXAJYMMUDR-YOQZMRDMSA-N HMDB0000845 253.081103865 254.088380265 252.073827465 Neopterin C9H11N5O4 BMQYVXCPAOLZOK-UHFFFAOYSA-N @@ -212,7 +209,7 @@ HMDB0000870 111.079647303 112.086923703 110.072370903 Histamine C5H9N3 NTYJJOPFIAHURM-UHFFFAOYSA-N HMDB0000883 117.078978601 118.086255001 116.071702201 L-Valine C5H11NO2 KZSNJWFQEVHDMF-BYPYZUCNSA-N HMDB0000893 174.089208936 175.096485336 173.081932536 "Suberic acid" C8H14O4 TYFQFVWCELRYAO-UHFFFAOYSA-N -HMDB0000895 146.118103761 147.125380161 145.110827361 "Acetylcholine " C7H16NO2 OIPILFWXSMYKGL-UHFFFAOYSA-N +HMDB0000895 146.118103761 147.125380161 145.110827361 Acetylcholine C7H16NO2 OIPILFWXSMYKGL-UHFFFAOYSA-N HMDB0000898 125.095297367 126.102573767 124.088020967 1-Methylhistamine C6H11N3 FHQDWPCFSJMNCT-UHFFFAOYSA-N HMDB0000904 175.095691297 176.102967697 174.088414897 Citrulline C6H13N3O3 RHGKLRLOHDJJDR-BYPYZUCNSA-N HMDB0000906 59.073499293 60.080775693 58.066222893 Trimethylamine C3H9N GETQZCLCWQTVFV-UHFFFAOYSA-N @@ -220,11 +217,11 @@ HMDB0000929 204.089877638 205.097154038 203.082601238 L-Tryptophan C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N HMDB0000939 384.12158847 385.12886487 383.11431207 S-Adenosylhomocysteine C14H20N6O5S ZJUKTBDSGOFHSH-WFMPWKQPSA-N HMDB0000990 44.02621475 45.03349115 43.01893835 Acetaldehyde C2H4O IKHGUXGNUITLKF-UHFFFAOYSA-N -HMDB0000996 153.009578407 154.016854807 152.002302007 3-Sulfinoalanine C3H7NO4S WVMUCBHSEHBMKA-REOHCLBHSA-N +HMDB0000996 153.009578407 154.016854807 152.002302007 3-Sulfinoalanine C3H7NO4S ADVPTQAUNPRNPO-REOHCLBHSA-N HMDB0001035 1045.534514801 1046.541791201 1044.527238401 "Angiotensin II" C50H71N13O12 CZGUSIXMZVURDU-JZXHSEFVSA-N HMDB0001043 304.240230268 305.247506668 303.232953868 "Arachidonic acid" C20H32O2 YZXBAPSDXZZRGB-DOFZRALJSA-N HMDB0001046 176.094963016 177.102239416 175.087686616 Cotinine C10H12N2O UIKROCXWUNQSPJ-UHFFFAOYSA-N -HMDB0001067 304.090665498 305.097941898 303.083389098 "N-Acetylaspartylglutamic acid" C11H16N2O8 OPVPGKGADVGKTG-UHFFFAOYSA-N +HMDB0001067 304.090665483 305.097941883 303.083389083 "N-Acetylaspartylglutamic acid" C11H16N2O8 OPVPGKGADVGKTG-BQBZGAKWSA-N HMDB0001085 336.230059512 337.237335912 335.222783112 "Leukotriene B4" C20H32O4 VNYSSYRCGWBHLG-AMOLWHMGSA-N HMDB0001123 137.047678473 138.054954873 136.040402073 "2-Aminobenzoic acid" C7H7NO2 RWZYAGGXGHYGMB-UHFFFAOYSA-N HMDB0001139 354.240624198 355.247900598 353.233347798 "Prostaglandin F2a" C20H34O5 PXGPLTODNUVGFL-UAAPODJFSA-N @@ -248,7 +245,7 @@ HMDB0001333 54.938049636 55.945326036 53.930773236 Manganese Mn WAEMQWOKJMHJLA-UHFFFAOYSA-N HMDB0001336 168.042258744 169.049535144 167.034982344 "3,4-Dihydroxybenzeneacetic acid" C8H8O4 CFFZDZCDUFSOFZ-UHFFFAOYSA-N HMDB0001341 427.029414749 428.036691149 426.022138349 ADP C10H15N5O10P2 XTWYTFMLZFPYCI-KQYNXXCUSA-N -HMDB0001348 731.606699942 732.613976342 730.599423542 SM(d18:1/18:0) C41H84N2O6P LKQLRGMMMAHREN-YJFXYUILSA-O +HMDB0001348 730.598875399 731.606151799 729.591598999 SM(d18:1/18:0) C41H83N2O6P LKQLRGMMMAHREN-YJFXYUILSA-N HMDB0001349 79.916521828 80.923798228 78.909245428 Selenium Se MFSBVGSNNPNWMD-UHFFFAOYSA-N HMDB0001355 291.033029765 292.040306165 290.025753365 Parathion C10H14NO5PS LCCNCVORNKJIRZ-UHFFFAOYSA-N HMDB0001372 425.044967696 426.052244096 424.037691296 "Thiamine pyrophosphate" C12H19N4O7P2S AYEKOFBPNLCAJY-UHFFFAOYSA-O @@ -268,13 +265,13 @@ HMDB0001488 123.032028409 124.039304809 122.024752009 "Nicotinic acid" C6H5NO2 PVNIIMVLHYAWGP-UHFFFAOYSA-N HMDB0001490 184.073558872 185.080835272 183.066282472 Vanylglycol C9H12O4 FBWPWWWZWKPJFL-UHFFFAOYSA-N HMDB0001491 247.024573569 248.031849969 246.017297169 "Pyridoxal 5'-phosphate" C8H10NO6P NGVDGCNFYWLIFO-UHFFFAOYSA-N -HMDB0001496 402.349780716 403.357057116 401.342504316 7a-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-AWBHSAGMSA-N +HMDB0001496 402.349780721 403.357057121 401.342504321 7alpha-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-RVOWOUOISA-N HMDB0001509 352.224974134 353.232250534 351.217697734 "20-Hydroxy-leukotriene B4" C20H32O5 PTJFJXLGRSTECQ-PSPARDEHSA-N HMDB0001522 73.063997239 74.071273639 72.056720839 Methylguanidine C2H7N3 CHJJGSNFBQVOTG-UHFFFAOYSA-N HMDB0001539 202.14297584 203.15025224 201.13569944 "Asymmetric dimethylarginine" C8H18N4O2 YDGMGEXADBMOMJ-LURJTMIESA-N HMDB0001545 167.058243159 168.065519559 166.050966759 Pyridoxal C8H9NO3 RADKZDMFGJYCBB-UHFFFAOYSA-N HMDB0001565 184.073869485 185.081145885 183.066593085 Phosphorylcholine C5H15NO4P YHHSONZFOIEMCP-UHFFFAOYSA-O -HMDB0001644 150.05282343 151.06009983 149.04554703 D-Xylulose C5H10O5 ZAQJHHRNXZUBTE-WUJLRWPWSA-N +HMDB0001644 150.05282343 151.06009983 149.04554703 D-Xylulose C5H10O5 LQXVFWRQNMEDEE-MROZADKFSA-N HMDB0001659 58.041864814 59.049141214 57.034588414 Acetone C3H6O CSCPPACGZOOCGX-UHFFFAOYSA-N HMDB0001830 314.224580204 315.231856604 313.217303804 Progesterone C21H30O2 RJKFOVLPORLFTN-LEKSSAKUSA-N HMDB0001842 59.048347175 60.055623575 58.041070775 Guanidine CH5N3 ZRALSGWEFCBTJO-UHFFFAOYSA-N @@ -285,7 +282,7 @@ HMDB0001860 180.06472552 181.07200192 179.05744912 Paraxanthine C7H8N4O2 QUNWUDVFRNGTCO-UHFFFAOYSA-N HMDB0001873 88.0524295 89.0597059 87.0451531 "Isobutyric acid" C4H8O2 KQNPFQTWMSNSAP-UHFFFAOYSA-N HMDB0001875 32.02621475 33.03349115 31.01893835 Methanol CH4O OKKJLVBELUTLKV-UHFFFAOYSA-N -HMDB0001881 76.0524295 77.0597059 75.0451531 "Propylene glycol" C3H8O2 DNIAPMSPPWPWGF-UHFFFAOYSA-N +HMDB0001881 76.0524295 77.0597059 75.0451531 "Propylene glycol" C3H8O2 DNIAPMSPPWPWGF-GSVOUGTGSA-N HMDB0001889 180.06472552 181.07200192 179.05744912 Theophylline C7H8N4O2 ZFXYFBGIUFBOJW-UHFFFAOYSA-N HMDB0001893 430.381080844 431.388357244 429.373804444 alpha-Tocopherol C29H50O2 GVJHHUAWPYXKBD-IEOSBIPESA-N HMDB0001896 191.094628665 192.101905065 190.087352265 5-Methoxytryptophol C11H13NO2 QLWKTGDEPLRFAT-UHFFFAOYSA-N @@ -294,7 +291,7 @@ HMDB0001920 271.193614427 272.200890827 270.186338027 Dextromethorphan C18H25NO MKXZASYAUGDDCJ-CGTJXYLNSA-N HMDB0001925 206.13067982 207.13795622 205.12340342 Ibuprofen C13H18O2 HEFNNWSXXWATRW-UHFFFAOYSA-N HMDB0001929 361.143784348 362.151060748 360.136507948 Levofloxacin C18H20FN3O4 GSDSWSVVBLHKDQ-JTQLQIEISA-N -HMDB0001959 231.158291553 232.165567953 230.151015153 Gamma-Aminobutyryl-lysine C10H21N3O3 OCBQYJFUZHJRIU-UHFFFAOYSA-N +HMDB0001959 231.158291548 232.165567948 230.151015148 gamma-Aminobutyryllysine C10H21N3O3 OCBQYJFUZHJRIU-QMMMGPOBSA-N HMDB0001960 123.933496699 124.940773099 122.926220299 Tin H4Sn PXQLTWWGPFDWNT-UHFFFAOYSA-N HMDB0001966 47.947947053 48.955223453 46.940670653 Titanium Ti LCKIEQZJEYYRIY-UHFFFAOYSA-N HMDB0001980 1055.431705989 1056.438982389 1054.424429589 Vasopressin C46H65N13O12S2 BJFIDCADFRDPIO-ZCCHBGLBSA-N @@ -303,11 +300,10 @@ HMDB0002017 121.089149357 122.096425757 120.081872957 1-Phenylethylamine C8H11N RQEUFEKYXDPUSK-UHFFFAOYSA-N HMDB0002024 126.042927446 127.050203846 125.035651046 "Imidazoleacetic acid" C5H6N2O2 PRJKNHOMHKJCEJ-UHFFFAOYSA-N HMDB0002027 384.33921603 385.34649243 383.33193963 8-Dehydrocholesterol C27H44O VUKORTMHZDZZFR-BXAZICILSA-N -HMDB0002031 146.069142196 147.076418596 145.061865796 "Ureidoisobutyric acid" C5H10N2O3 PHENTZNALBMCQD-UHFFFAOYSA-N +HMDB0002031 146.069142196 147.076418596 145.061865796 "Ureidoisobutyric acid" C5H10N2O3 PHENTZNALBMCQD-VKHMYHEASA-N HMDB0002032 167.044324429 168.051600829 166.037048029 8-Hydroxyguanine C5H5N5O2 CLGFIVUFZRGQRP-UHFFFAOYSA-N HMDB0002038 160.121177766 161.128454166 159.113901366 N(6)-Methyllysine C7H16N2O2 PQNASZJZHFPQLE-LURJTMIESA-N HMDB0002044 299.086583173 300.093859573 298.079306773 8-Hydroxyguanosine C10H13N5O6 FPGSEBKFEJEOSA-UMMCILCDSA-N -HMDB0002061 "Hyaluronic acid" (C14H21NO11)nH2O LJKKEBYAXYCTNF-GIXQJHCPSA-N HMDB0002100 299.282429433 300.289705833 298.275153033 Palmitoylethanolamide C18H37NO2 HXYVTAGFYLMHSO-UHFFFAOYSA-N HMDB0002103 402.349780716 403.357057116 401.342504316 27-Hydroxycholesterol C27H46O2 FYHRJWMENCALJY-YSQMORBQSA-N HMDB0002111 18.010564686 19.017841086 17.003288286 Water H2O XLYOFNOQVPJJNP-UHFFFAOYSA-N @@ -331,7 +327,7 @@ HMDB0002500 78.918337647 79.925614047 77.911061247 Bromide Br CPELXLSAUQHCOX-UHFFFAOYSA-M HMDB0002503 50.943963675 51.951240075 49.936687275 Vanadium V KOKKJWHERHSKEB-UHFFFAOYSA-N HMDB0002659 106.90509302 107.91236942 105.89781662 Silver Ag FOIXSVOLVBLSDH-UHFFFAOYSA-N -HMDB0002666 344.070812254 345.078088654 343.063535854 "Thiamine monophosphate" C12H17N4O4PS HZSAJDVWZRBGIF-UHFFFAOYSA-N +HMDB0002666 345.078637286 346.085913686 344.071360886 "Thiamine monophosphate" C12H18N4O4PS HZSAJDVWZRBGIF-UHFFFAOYSA-O HMDB0002712 164.068473494 165.075749894 163.061197094 1,5-Anhydrosorbitol C6H12O5 MPCAJMNYNOGXPB-SLPGGIOYSA-N HMDB0002786 47.000728281 48.008004681 45.993451881 Nitrite HNO2 IOVCWXUNBOPUCH-UHFFFAOYSA-N HMDB0002820 140.05857751 141.06585391 139.05130111 "Methylimidazoleacetic acid" C6H8N2O2 ZHCKPJGJQOPTLB-UHFFFAOYSA-N @@ -339,7 +335,7 @@ HMDB0002865 1006.436457016 1007.443733416 1005.429180616 Oxytocin C43H66N12O12S2 XNOPRXBHLZRZKH-MQYCRUOZSA-N HMDB0002878 61.987817871 62.995094271 60.980541471 Nitrate NO3 NHNBFGGVMKEFGY-UHFFFAOYSA-N HMDB0002886 370.23553882 371.24281522 369.22826242 "6-Keto-prostaglandin F1a" C20H34O6 KFGOFTHODYBSGM-ZUNNJUQCSA-N -HMDB0002917 152.068473494 153.075749894 151.061197094 D-Xylitol C5H12O5 HEBKCHPVOIAQTA-NGQZWQHPSA-N +HMDB0002917 152.068473494 153.075749894 151.061197094 D-Xylitol C5H12O5 HEBKCHPVOIAQTA-SCDXWVJYSA-N HMDB0002961 290.224580204 291.231856604 289.217303804 Dihydrotestosterone C19H30O2 NVKAWKQGWWIWPM-ABEVXSGRSA-N HMDB0002994 122.057908808 123.065185208 121.050632408 Erythritol C4H10O4 UNXHWFMMPAWVPI-ZXZARUISSA-N HMDB0003080 496.26070819 497.26798459 495.25343179 "Leukotriene D4" C25H40N2O6S YEESKJGWJFYOOK-IJHYULJSSA-N @@ -348,19 +344,18 @@ HMDB0003229 254.224580204 255.231856604 253.217303804 "Palmitoleic acid" C16H30O2 SECPZKHBENQXJG-FPLPWBNLSA-N HMDB0003252 370.23553882 371.24281522 369.22826242 "Thromboxane B2" C20H34O6 XNRNNGPBEPRNAR-JQBLCGNGSA-N HMDB0003332 264.030373428 265.037649828 263.023097028 "3-Methoxy-4-Hydroxyphenylglycol sulfate" C9H12O7S SBKADJXSGGTEPN-UHFFFAOYSA-N -HMDB0003337 612.151961898 613.159238298 611.144685498 "Oxidized glutathione" C20H32N6O12S2 YPZRWBKMTBYPTK-UHFFFAOYSA-N +HMDB0003337 612.151961898 613.159238298 611.144685498 "Oxidized glutathione" C20H32N6O12S2 YPZRWBKMTBYPTK-BJDJZHNGSA-N HMDB0003366 58.041864814 59.049141214 57.034588414 Propanal C3H6O NBBJYMSMWIIQGU-UHFFFAOYSA-N HMDB0003378 29.997988627 31.005265027 28.990712227 "Nitric oxide" NO MWUXSHHQAYIFBG-UHFFFAOYSA-N HMDB0003379 257.909555916 258.916832316 256.902279516 Triphosphate H5O10P3 UNXRWKVEANCORM-UHFFFAOYSA-N -HMDB0003406 105.042593095 106.049869495 104.035316695 D-Serine C3H7NO3 MTCFGRXMJLQNBG-UWTATZPHSA-N HMDB0003464 145.085126611 146.092403011 144.077850211 "4-Guanidinobutanoic acid" C5H11N3O2 TUHVEAJXIMEOSA-UHFFFAOYSA-N HMDB0003625 201.970625604 202.977902004 200.963349204 Mercury Hg BQPIGGFYSBELGY-UHFFFAOYSA-N HMDB0003626 193.110278729 194.117555129 192.103002329 (R)-N-Methylsalsolinol C11H15NO2 RKMGOUZXGHZLBJ-SSDOTTSWSA-N HMDB0003638 113.903358121 114.910634521 112.896081721 Cadmium Cd WLZRMCYVCSSEQC-UHFFFAOYSA-N HMDB0003642 87.905614339 88.912890739 86.898337939 Strontium Sr PWYYWQHXAPXYMF-UHFFFAOYSA-N HMDB0003671 114.10446507 115.11174147 113.09718867 2-Heptanone C7H14O CATSNJVOTSVZJV-UHFFFAOYSA-N -HMDB0003869 275.148120797 276.155397197 274.140844397 Epsilon-(gamma-Glutamyl)-lysine C11H21N3O5 JPKNLFVGUZRHOB-YUMQZZPRSA-N -HMDB0003876 320.23514489 321.24242129 319.22786849 15(S)-HETE C20H32O3 JSFATNQSLKRBCI-VAEKSGALSA-N +HMDB0003869 275.148120797 276.155397197 274.140844397 epsilon-(gamma-Glutamyl)lysine C11H21N3O5 JPKNLFVGUZRHOB-YUMQZZPRSA-N +HMDB0003876 320.23514489 321.24242129 319.22786849 15-HETE C20H32O3 JSFATNQSLKRBCI-VAEKSGALSA-N HMDB0003892 193.110278729 194.117555129 192.103002329 (S)-N-Methylsalsolinol C11H15NO2 RKMGOUZXGHZLBJ-ZETCQYMHSA-N HMDB0003933 378.20155335 379.20882975 377.19427695 Pentosidine C17H26N6O4 AYEKKSTZQYEZPU-RYUDHWBXSA-N HMDB0004063 197.105193351 198.112469751 196.097916951 Metanephrine C10H15NO3 JWJCTZKFYGDABJ-UHFFFAOYSA-N @@ -382,16 +377,17 @@ HMDB0004628 207.97663585 208.98391225 206.96935945 Lead Pb RVPVRDXYQKGNMQ-UHFFFAOYSA-N HMDB0004645 336.073969576 337.081245976 335.066693176 S-Nitrosoglutathione C10H16N4O7S HYHSBSXUHZOYLX-WDSKDSINSA-N HMDB0004659 280.31300128 281.32027768 279.30572488 8-Isoprostane C20H40 UKVVPDHLUHAJNZ-UXHICEINSA-N -HMDB0004666 378.277009704 379.284286104 377.269733304 2-Arachidonylglycerol C23H38O4 RCRCTBLIHCHWDZ-DOFZRALJSA-N -HMDB0004667 296.23514489 297.24242129 295.22786849 "13S-hydroxyoctadecadienoic acid" C18H32O3 HNICUWMFWZBIFP-IRQZEAMPSA-N +HMDB0004666 378.277009704 379.284286104 377.269733304 MG(0:0/20:4(5Z,8Z,11Z,14Z)/0:0) C23H38O4 RCRCTBLIHCHWDZ-DOFZRALJSA-N +HMDB0004667 296.23514489 297.24242129 295.22786849 13-HODE C18H32O3 HNICUWMFWZBIFP-IRQZEAMPSA-N HMDB0004669 294.219494826 295.226771226 293.212218426 9-OxoODE C18H30O3 LUZSWWYKKLTDHU-ZJHFMPGASA-N -HMDB0004670 296.23514489 297.24242129 295.22786849 "Alpha-dimorphecolic acid" C18H32O3 NPDSHTNEKLQQIJ-UINYOVNOSA-N +HMDB0004670 296.23514489 297.24242129 295.22786849 "alpha-Dimorphecolic acid" C18H32O3 NPDSHTNEKLQQIJ-UINYOVNOSA-N +HMDB0004673 320.23514489 321.24242129 319.22786849 "11,12-Epoxyeicosatrienoic acid" C20H32O3 DXOYQVHGIODESM-LZXKBWHHSA-N HMDB0004679 320.23514489 321.24242129 319.22786849 8-HETE C20H32O3 NLUNAYAEIJYXRB-VYOQERLCSA-N HMDB0004682 320.23514489 321.24242129 319.22786849 11(R)-HETE C20H32O3 GCZRCCHPLVMMJE-RSPKXIRXSA-N HMDB0004701 296.23514489 297.24242129 295.22786849 "9,10-Epoxyoctadecenoic acid" C18H32O3 FBUKMFOXMZRGRB-YFHOEESVSA-N HMDB0004702 296.23514489 297.24242129 295.22786849 12,13-EpOME C18H32O3 CCPPLLJZDQAOHD-FLIBITNWSA-N -HMDB0004704 314.245709576 315.252985976 313.238433176 9,10-DHOME C18H34O4 XEBKSQSGNGRGDW-YFHOEESVSA-N -HMDB0004705 314.245709576 315.252985976 313.238433176 12,13-DHOME C18H34O4 CQSLTKIXAJTQGA-FLIBITNWSA-N +HMDB0004704 314.245709575 315.252985975 313.238433175 9,10-DHOME C18H34O4 XEBKSQSGNGRGDW-GJWDQICYSA-N +HMDB0004705 314.245709575 315.252985975 313.238433175 12,13-DHOME C18H34O4 CQSLTKIXAJTQGA-BTDPBSJTSA-N HMDB0004710 330.240624198 331.247900598 329.233347798 9,10,13-TriHOME C18H34O5 NTVFQBIHLSPEGQ-SYMVGPSASA-N HMDB0004983 94.008850126 95.016126526 93.001573726 "Dimethyl sulfone" C2H6O2S HHVIBTZHLRERCL-UHFFFAOYSA-N HMDB0004988 140.05857751 141.06585391 139.05130111 "Pi-Methylimidazoleacetic acid" C6H8N2O2 UJCGYTCAMOHYCG-UHFFFAOYSA-N @@ -403,25 +399,23 @@ HMDB0005998 320.23514489 321.24242129 319.22786849 "20-Hydroxyeicosatetraenoic acid" C20H32O3 NNDIXBJHNLFJJP-DTLRTWKJSA-N HMDB0006059 366.204238692 367.211515092 365.196962292 "20-Carboxy-leukotriene B4" C20H30O6 SXWGPVJGNOLNHT-VFLUTPEKSA-N HMDB0006088 180.063388116 181.070664516 179.056111716 scyllo-Inositol C6H12O6 CDAISMWEOUEBRE-CDRYSYESSA-N -HMDB0006111 320.23514489 321.24242129 319.22786849 12-HETE C20H32O3 ZNHVWPKMFKADKW-FYMOKONMSA-N +HMDB0006111 320.23514489 321.24242129 319.22786849 12-HETE C20H32O3 ZNHVWPKMFKADKW-LQWMCKPYSA-N HMDB0006112 72.021129372 73.028405772 71.013852972 Malondialdehyde C3H4O2 WSMYVTOQOOLQHP-UHFFFAOYSA-N -HMDB0006119 402.349780716 403.357057116 401.342504316 7b-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-KGZHIOMZSA-N -HMDB0006478 86.073164942 87.080441342 85.065888542 Iso-Valeraldehyde C5H10O YGHRJJRRZDOVPD-UHFFFAOYSA-N +HMDB0006119 402.349780716 403.357057116 401.342504316 7beta-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-KGZHIOMZSA-N +HMDB0006478 86.073164942 87.080441342 85.065888542 Isovaleraldehyde C5H10O YGHRJJRRZDOVPD-UHFFFAOYSA-N HMDB0006483 133.037507717 134.044784117 132.030231317 "D-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-UWTATZPHSA-N HMDB0006695 228.11100701 229.11828341 227.10373061 Prolylhydroxyproline C10H16N2O4 ONPXCLZMBSJLSP-CSMHCCOUSA-N HMDB0006730 609.239454997 610.246731397 608.232178597 QYNAD C25H35N7O11 WKBAPRRMZYHPNB-BXBUPLCLSA-N -HMDB0010169 703.575399814 704.582676214 702.568123414 SM(d18:1/16:0) C39H80N2O6P RWKUXQNLWDTSLO-GWQJGLRPSA-O +HMDB0010169 702.567574782 703.574851182 701.560298382 SM(d18:1/16:0) C39H79N2O6P RWKUXQNLWDTSLO-GWQJGLRPSA-N HMDB0010210 318.219494826 319.226771226 317.212218426 15-KETE C20H30O3 YGJTUEISKATQSM-USWFWKISSA-N HMDB0010222 320.23514489 321.24242129 319.22786849 9-HETE C20H32O3 KATOYYZUTNAWSA-DLJQHUEDSA-N -HMDB0010223 296.23514489 297.24242129 295.22786849 9-HODE C18H32O3 NPDSHTNEKLQQIJ-SIGMCMEVSA-N -HMDB0010384 523.363789599 524.371065999 522.356513199 LysoPC(18:0) C26H54NO7P IHNKQIMGVNPMTC-RUZDIDTESA-N -HMDB0010395 543.332489471 544.339765871 542.325213071 LysoPC(20:4(5Z,8Z,11Z,14Z)) C28H50NO7P LAXQYRRMGGEGOH-JXRLJXCWSA-N -HMDB0010396 543.332489471 544.339765871 542.325213071 LysoPC(20:4(8Z,11Z,14Z,17Z)) C28H50NO7P GOMVPVRDBLLHQC-VEJNOCSESA-N -HMDB0010409 320.23514489 321.24242129 319.22786849 11,12-EpETrE C20H32O3 DXOYQVHGIODESM-IQCOFVSKSA-N +HMDB0010384 523.363789599 524.371065999 522.356513199 LysoPC(18:0/0:0) C26H54NO7P IHNKQIMGVNPMTC-RUZDIDTESA-N +HMDB0010395 543.332489471 544.339765871 542.325213071 LysoPC(20:4(5Z,8Z,11Z,14Z)/0:0) C28H50NO7P LAXQYRRMGGEGOH-JXRLJXCWSA-N +HMDB0010396 543.332489471 544.339765871 542.325213071 LysoPC(20:4(8Z,11Z,14Z,17Z)/0:0) C28H50NO7P GOMVPVRDBLLHQC-VEJNOCSESA-N HMDB0011134 320.23514489 321.24242129 319.22786849 5-HETE C20H32O3 KGIJOOYOSFUGPC-JGKLHWIESA-N HMDB0011620 125.929815379 126.937091779 124.922538979 Arsenite AsH3O3 GCPXMJHSNVMWNM-UHFFFAOYSA-N -HMDB0011697 815.700600326 816.707876726 814.693323926 SM(d18:1/24:0) C47H96N2O6P QEDPUVGSSDPBMD-XTAIVQBESA-O -HMDB0011698 843.731900454 844.739176854 842.724624054 SM(d18:1/26:0) C49H100N2O6P VRAWSAPVSSLIRI-MVUJCARGSA-O +HMDB0011697 814.692775785 815.700052185 813.685499385 SM(d18:1/24:0) C47H95N2O6P QEDPUVGSSDPBMD-XTAIVQBESA-N +HMDB0011698 842.724075914 843.731352314 841.716799514 SM(d18:1/26:0) C49H99N2O6P VRAWSAPVSSLIRI-MVUJCARGSA-N HMDB0011738 275.111735291 276.119011691 274.104458891 N2-gamma-Glutamylglutamine C10H17N3O6 JBFYFLXEJFQWMU-WDSKDSINSA-N HMDB0012100 728.583224846 729.590501246 727.575948446 SM(d18:1/18:1(11Z)) C41H81N2O6P FZMKZVXNTLAHFD-RTEXEOPXSA-N HMDB0012101 728.583224846 729.590501246 727.575948446 SM(d18:1/18:1(9Z)) C41H81N2O6P NBEADXWAAWCCDG-QDDWGVBQSA-N @@ -429,7 +423,7 @@ HMDB0012895 1027.400405861 1028.407682261 1026.393129461 "Arginine vasopressin 1-8" C44H61N13O12S2 SXYIOPJBWYQZRQ-VMPYSSHJSA-N HMDB0012935 1474.912295913 1475.919572313 1473.905019513 "Dynorphin A" C69H116N23O13 ZIHYAUCIMOSJIH-QGLXRRFISA-O HMDB0013072 1650.73230468 1651.73958108 1649.72502828 Somatostatin C77H106N18O19S2 KTEPWBJBSMMZIC-LJTSQLRWSA-N -HMDB0013122 507.368874977 508.376151377 506.361598577 LysoPC(P-18:0) C26H54NO6P WBOMIOWRFSPZMC-AYICAFKVSA-N +HMDB0013122 507.368874977 508.376151377 506.361598577 LysoPC(P-18:0/0:0) C26H54NO6P WBOMIOWRFSPZMC-AYICAFKVSA-N HMDB0013125 233.126322723 234.133599123 232.119046323 Hydroxypropionylcarnitine C10H19NO5 QJGJXKFJFRSERW-QMMMGPOBSA-N HMDB0013128 246.169984677 247.177261077 245.162708277 Valerylcarnitine C12H24NO4 VSNFQQXVMPSASB-SNVBAGLBSA-O HMDB0013461 840.708425358 841.715701758 839.701148958 SM(d18:1/26:1(17Z)) C49H97N2O6P YXEXWUZHFGYOHJ-UOJCCMJYSA-N @@ -446,6 +440,6 @@ HMDB0013670 105.903483087 106.910759487 104.896206687 Palladium Pd KDLHZDBZIXYQEI-UHFFFAOYSA-N HMDB0013671 194.964774449 195.972050849 193.957498049 Platinum Pt BASFCYQUMIYNBI-UHFFFAOYSA-N HMDB0013672 139.905434035 140.912710435 138.898157635 Cerium Ce GWXLDORMOJMVQZ-UHFFFAOYSA-N -HMDB0015532 63.929146578 64.936422978 62.921870178 Zinc Zn HCHKCACWOHOZIP-UHFFFAOYSA-N +HMDB0015532 63.929146578 64.936422978 62.921870178 Zinc Zn PTFCDOFLOPIGGS-UHFFFAOYSA-N HMDB0029147 275.111735279 276.119011679 274.104458879 N-gamma-Glutamylglutamine C10H17N3O6 FCWNOQOVMGNKNG-WDSKDSINSA-N HMDB0059655 148.037173366 149.044449766 147.029896966 2-Hydroxyglutarate C5H8O5 HWXBTNAVRSUOJR-UHFFFAOYSA-N
--- a/test-data/out02.tabular Tue Jan 21 16:09:45 2020 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,138 +0,0 @@ -HMDB_ID COMMON_NAME CAS FORMULA MZ_MONO MZ_AVERAGE MZ_[M+H]+ MZ_[M-H]- KEGG_ID BIOCYC_ID INCHI LOCATION TAXONOMY IUPAC -HMDB00020 "p-Hydroxyphenylacetic acid" 156-38-7 C8H8O3 152.047348 152.147 153.0546244 151.0400716 C00642 4-HYDROXYPHENYLACETATE InChI=1/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11) Rumen "Organic acids" "2-(4-hydroxyphenyl)acetic acid" -HMDB00033 Carnosine 305-84-0 C9H14N4O3 226.106583 226.232 227.1138594 225.0993066 C00386 CARNOSINE InChI=1/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-(3-aminopropanoylamino)-3-(3H-imidazol-4-yl)propanoic acid" -HMDB00039 "Butyric acid" 107-92-6 C4H8O2 88.052429 88.105 89.0597054 87.0451526 C00246 "Not Available" InChI=1/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6) Rumen "Organic acids" "Butanoic acid" -HMDB00042 "Acetic acid" 64-19-7 C2H4O2 60.021130 60.052 61.0284064 59.0138536 C00033 ACET InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4) Rumen "Organic acids" "acetic acid" -HMDB00060 "Acetoacetic acid" 541-50-4 C4H6O3 102.031693 102.089 103.0389694 101.0244166 C00164 3-KETOBUTYRATE InChI=1/C4H6O3/c1-3(5)2-4(6)7/h2H2,1H3,(H,6,7) Rumen "Organic acids" "3-oxobutanoic acid" -HMDB00097 Choline 62-49-7 C5H14NO 104.107536 104.171 105.1148124 103.1002596 C00114 CPD-563 InChI=1/C5H14NO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1 Rumen "Amino acids and Amino Acid conjugates" 2-hydroxyethyl-trimethyl-ammonium -HMDB00108 Ethanol 64-17-5 C2H6O 46.041866 46.068 47.0491424 45.0345896 C00469 ETOH InChI=1/C2H6O/c1-2-3/h3H,2H2,1H3 Rumen Alcohols ethanol -HMDB00122 D-Glucose 50-99-7 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00031 GLC InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6u/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3R,4R,5S,6S)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB00123 Glycine 56-40-6 C2H5NO2 75.032028 75.067 76.0393044 74.0247516 C00037 GLY InChI=1/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) Rumen "Amino acids and Amino Acid conjugates" "2-aminoacetic acid" -HMDB00131 Glycerol 56-81-5 C3H8O3 92.047340 92.094 93.0546164 91.0400636 C00116 GLYCEROL InChI=1/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2 Rumen Alcohols 1,2,3-Propanetriol -HMDB00134 "Fumaric acid" 110-17-8 C4H4O4 116.010956 116.072 117.0182324 115.0036796 C00122 FUM InChI=1/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+ Rumen "Organic acids" "(E)-2-Butenedioic acid" -HMDB00142 "Formic acid" 64-18-6 CH2O2 46.005478 46.025 47.0127544 44.9982016 C00058 FORMATE InChI=1/CH2O2/c2-1-3/h1H,(H,2,3) Rumen "Organic acids" "Formic acid" -HMDB00143 D-Galactose 59-23-4 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00124 GALACTOSE InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6+/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" alpha-D-galactopyranose -HMDB00149 Ethanolamine 141-43-5 C2H7NO 61.052765 61.083 62.0600414 60.0454886 C00189 ETHANOL-AMINE InChI=1/C2H7NO/c3-1-2-4/h4H,1-3H2 Rumen Alcohols 2-aminoethanol -HMDB00157 Hypoxanthine 68-94-0 C5H4N4O 136.038513 136.111 137.0457894 135.0312366 C00262 HYPOXANTHINE InChI=1/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10) Rumen "Nucleosides and Nucleoside conjugates" 3,7-dihydropurin-6-one -HMDB00158 L-Tyrosine 60-18-4 C9H11NO3 181.073898 181.189 182.0811744 180.0666216 C00082 TYR InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-(4-hydroxyphenyl)-propanoic acid" -HMDB00159 L-Phenylalanine 63-91-2 C9H11NO2 165.078979 165.189 166.0862554 164.0717026 C00079 PHE InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-phenyl-propanoic acid" -HMDB00161 L-Alanine 56-41-7 C3H7NO2 89.047676 89.093 90.0549524 88.0403996 C00041 L-ALPHA-ALANINE InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-aminopropanoic acid" -HMDB00162 L-Proline 147-85-3 C5H9NO2 115.063332 115.131 116.0706084 114.0560556 C00148 PRO InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-pyrrolidine-2-carboxylic acid" -HMDB00163 D-Maltose 69-79-4 C12H22O11 342.116211 342.297 343.1234874 341.1089346 C00208 MALTOSE InChI=1/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8+,9-,10-,11+,12-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol -HMDB00164 Methylamine 74-89-5 CH5N 31.042198 31.057 32.0494744 30.0349216 C00218 CPD-4521 InChI=1/CH5N/c1-2/h2H2,1H3 Rumen Amines methanamine -HMDB00167 L-Threonine 72-19-5 C4H9NO3 119.058243 119.119 120.0655194 118.0509666 C00188 THR InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-hydroxy-butanoic acid" -HMDB00169 D-Mannose 3458-28-4 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00159 MANNOSE InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5+,6?/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3S,4S,5R,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB00172 L-Isoleucine 73-32-5 C6H13NO2 131.094635 131.173 132.1019114 130.0873586 C00407 ILE InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-methylpentanoic acid" -HMDB00174 L-Fucose 2438-80-4 C6H12O5 164.068481 164.156 165.0757574 163.0612046 C01019 L-FUCOSE InChI=1/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol -HMDB00177 L-Histidine 71-00-1 C6H9N3O2 155.069473 155.155 156.0767494 154.0621966 C00135 HIS InChI=1/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-(3H-imidazol-4-yl)propanoic acid" -HMDB00182 L-Lysine 56-87-1 C6H14N2O2 146.105530 146.188 147.1128064 145.0982536 C00047 LYS InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2,6-diaminohexanoic acid" -HMDB00187 L-Serine 56-45-1 C3H7NO3 105.042595 105.093 106.0498714 104.0353186 C00065 SER InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-3-hydroxy-propanoic acid" -HMDB00190 "L-Lactic acid" 79-33-4 C3H6O3 90.031693 90.078 91.0389694 89.0244166 C00186 L-LACTATE InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1 Rumen "Organic acids" "(2S)-2-hydroxypropanoic acid" -HMDB00191 "L-Aspartic acid" 56-84-8 C4H7NO4 133.037506 133.103 134.0447824 132.0302296 C00049 L-ASPARTATE InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-aminobutanedioic acid" -HMDB00202 "Methylmalonic acid" 516-05-2 C4H6O4 118.026611 118.088 119.0338874 117.0193346 C02170 "Not Available" InChI=1/C4H6O4/c1-2(3(5)6)4(7)8/h2H,1H3,(H,5,6)(H,7,8) Rumen "Organic acids" "2-methylpropanedioic acid" -HMDB00205 "Phenylpyruvic acid" 156-06-9 C9H8O3 164.047348 164.158 165.0546244 163.0400716 C00166 PHENYL-PYRUVATE InChI=1/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) Rumen "Organic acids" "2-oxo-3-phenyl-propanoic acid" -HMDB00207 "Oleic acid" 112-80-1 C18H34O2 282.255890 282.461 283.2631664 281.2486136 C00712 OLEATE-CPD InChI=1/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9- Rumen "Organic acids" "9-Octadecenoic acid" -HMDB00209 "Phenylacetic acid" 103-82-2 C8H8O2 136.052429 136.148 137.0597054 135.0451526 C07086 PHENYLACETATE InChI=1/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10) Rumen "Organic acids" "2-phenylacetic acid" -HMDB00214 Ornithine 70-26-8 C5H12N2O2 132.089874 132.161 133.0971504 131.0825976 C00077 L-ORNITHINE InChI=1/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2,5-diaminopentanoic acid" -HMDB00215 N-Acetyl-D-glucosamine 7512-17-6 C8H15NO6 221.089935 221.208 222.0972114 220.0826586 C00140 ALPHA-D-GALACTOSYL-13-BETA-D-GALACTOS InChI=1/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8+/m0/s1 Rumen "Carbohydrates and Carbohydrate conjugates" N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide -HMDB00220 "Palmitic acid" 57-10-3 C16H32O2 256.240234 256.424 257.2475104 255.2329576 C00249 CPD-8475 InChI=1/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18) Rumen "Organic acids" "Hexadecanoic acid" -HMDB00222 L-Palmitoylcarnitine 2364-67-2 C23H45NO4 399.334869 399.608 400.3421454 398.3275926 C02990 CPD-419 InChI=1/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3/t21-/m1/s1 Rumen "Amino acids and Amino Acid conjugates" (3R)-3-hexadecanoyloxy-4-trimethylazaniumylbutanoate -HMDB00235 Thiamine 59-43-8 C12H17N4OS 265.112305 265.355 266.1195814 264.1050286 C00378 THIAMINE InChI=1/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1 Rumen Miscellanous 2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1-thia-3-azoniacyclopenta-2,4-dien-5-yl]ethanol -HMDB00237 "Propionic acid" 79-09-4 C3H6O2 74.036781 74.078 75.0440574 73.0295046 C00163 PROPIONATE InChI=1/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5) Rumen "Organic acids" "Propanoic acid" -HMDB00251 Taurine 107-35-7 C2H7NO3S 125.014664 125.147 126.0219404 124.0073876 C00245 "Not Available" InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) Rumen "Amino acids and Amino Acid conjugates" "2-amino-Ethanesulfonic acid" -HMDB00254 "Succinic acid" 110-15-6 C4H6O4 118.026611 118.088 119.0338874 117.0193346 C00042 SUC InChI=1/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8) Rumen "Organic acids" "Butanedioic acid" -HMDB00259 Serotonin 50-67-9 C10H12N2O 176.094955 176.215 177.1022314 175.0876786 C00780 "Not Available" InChI=1/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2 Rumen "Heterocyclic molecules" 3-(2-aminoethyl)-1H-Indol-5-ol -HMDB00262 Thymine 65-71-4 C5H6N2O2 126.042931 126.113 127.0502074 125.0356546 C00178 THYMINE InChI=1/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9) Rumen "Nucleosides and Nucleoside conjugates" 5-methyl-2,4(1H,3H)-pyrimidinedione -HMDB00267 "Pyroglutamic acid" 98-79-3 C5H7NO3 129.042587 129.114 130.0498634 128.0353106 C01879 CPD-589 InChI=1/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-5-oxopyrrolidine-2-carboxylic acid" -HMDB00271 Sarcosine 107-97-1 C3H7NO2 89.047676 89.093 90.0549524 88.0403996 C00213 SARCOSINE InChI=1/C3H7NO2/c1-4-2-3(5)6/h4H,2H2,1H3,(H,5,6) Rumen "Amino acids and Amino Acid conjugates" "2-methylaminoacetic acid" -HMDB00283 D-Ribose 50-69-1 C5H10O5 150.052826 150.130 151.0601024 149.0455496 C00121 CPD-560 InChI=1/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5?/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3R,4R,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol -HMDB00292 Xanthine 69-89-6 C5H4N4O2 152.033432 152.111 153.0407084 151.0261556 C00385 XANTHINE InChI=1/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11) Rumen "Nucleosides and Nucleoside conjugates" 2,6-dihydroxypurin -HMDB00294 Urea 57-13-6 CH4N2O 60.032364 60.055 61.0396404 59.0250876 C00086 UREA InChI=1/CH4N2O/c2-1(3)4/h(H4,2,3,4) Rumen "Ketones and Aldehydes" Urea -HMDB00300 Uracil 66-22-8 C4H4N2O2 112.027275 112.087 113.0345514 111.0199986 C00106 URACIL InChI=1/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8) Rumen "Nucleosides and Nucleoside conjugates" 2,4(1H,3H)-Pyrimidinedione -HMDB00357 "3-Hydroxybutyric acid" 300-85-6 C4H8O3 104.047340 104.104 105.0546164 103.0400636 C01089 CPD-335 InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7) Rumen "Organic acids" "3-hydroxybutanoic acid" -HMDB00440 "3-Hydroxyphenylacetic acid" 621-37-4 C8H8O3 152.047348 152.147 153.0546244 151.0400716 C05593 3-HYDROXYPHENYLACETATE InChI=1/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11) Rumen "Organic acids" "2-(3-hydroxyphenyl)acetic acid" -HMDB00464 Calcium 7440-70-2 [Ca]2+ 39.962589 40.078 40.9698654 38.9553126 C00076 CA%2b2 InChI=1/Ca/q+2 Rumen "Inorganic compounds" calcium -HMDB00516 Beta-D-Glucose 492-61-5 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00221 "Not Available" InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (2R,3R,4S,5R,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB00517 L-Arginine 74-79-3 C6H14N4O2 174.111679 174.201 175.1189554 173.1044026 C00062 ARG InChI=1/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid" -HMDB00610 CE(18:2(9Z,12Z)) 604-33-1 C45H76O2 648.584534 649.084 649.5918104 647.5772576 C15441 Cholesterol-esters InChI=1/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h11-12,14-15,26,35-36,38-42H,7-10,13,16-25,27-34H2,1-6H3/b12-11-,15-14-/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1 Rumen "Cholesterols and derivatives" [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dode -HMDB00641 L-Glutamine 56-85-9 C5H10N2O3 146.069138 146.145 147.0764144 145.0618616 C00064 GLN InChI=1/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-4-carbamoyl-butanoic acid" -HMDB00658 CE(16:1(9Z)) 16711-66-3 C43H74O2 622.568909 623.047 623.5761854 621.5616326 C02530 Cholesterol-esters InChI=1/C43H74O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-41(44)45-36-28-30-42(5)35(32-36)24-25-37-39-27-26-38(34(4)22-20-21-33(2)3)43(39,6)31-29-40(37)42/h12-13,24,33-34,36-40H,7-11,14-23,25-32H2,1-6H3/b13-12-/t34-,36?,37?,38-,39?,40?,42+,43-/m1/s1 Rumen "Cholesterols and derivatives" [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2, -HMDB00660 D-Fructose 53188-23-1 C6H12O6 180.063385 180.156 181.0706614 179.0561086 "C02336; C00095" CPD-535 InChI=1/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5+,6-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol -HMDB00673 "Linoleic acid" 60-33-3 C18H32O2 280.240234 280.445 281.2475104 279.2329576 C01595 "Not Available" InChI=1/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9- Rumen "Organic acids" "9,12-Octadecadienoic acid" -HMDB00684 L-Kynurenine 343-65-7 C10H12N2O3 208.084793 208.214 209.0920694 207.0775166 C01718 L-KYNURENINE InChI=1/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "2-amino-4-(2-aminophenyl)-4-oxo-butanoic acid" -HMDB00687 L-Leucine 61-90-5 C6H13NO2 131.094635 131.173 132.1019114 130.0873586 C00123 LEU InChI=1/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-4-methyl-pentanoic acid" -HMDB00696 L-Methionine 63-68-3 C5H11NO2S 149.051056 149.211 150.0583324 148.0437796 C00073 MET InChI=1/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-4-methylsulfanyl-butanoic acid" -HMDB00710 "4-Hydroxybutyric acid" 591-81-1 C4H8O3 104.047340 104.104 105.0546164 103.0400636 C00989 CPD-3193 InChI=1/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7) Rumen "Organic acids" "4-hydroxy-butanoic acid" -HMDB00718 "Isovaleric acid" 503-74-2 C5H10O2 102.068077 102.132 103.0753534 101.0608006 C08262 "Not Available" InChI=1/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7) Rumen "Organic acids" "3-methyl-butanoic acid" -HMDB00738 Indole 120-72-9 C8H7N 117.057846 117.148 118.0651224 116.0505696 C00463 INDOLE InChI=1/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H Rumen "Heterocyclic molecules" 1H-indole -HMDB00764 "Hydrocinnamic acid" 501-52-0 C9H10O2 150.068085 150.174 151.0753614 149.0608086 C05629 "Not Available" InChI=1/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) Rumen "Organic acids" "Benzenepropanoic acid" -HMDB00806 "Myristic acid" 544-63-8 C14H28O2 228.208923 228.371 229.2161994 227.2016466 C06424 "Not Available" InChI=1/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16) Rumen "Organic acids" "tetradecanoic acid" -HMDB00821 Phenylacetylglycine 500-98-1 C10H11NO3 193.073898 193.199 194.0811744 192.0666216 C05596 "Not Available" InChI=1/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14) Rumen "Amino acids and Amino Acid conjugates" "2-(2-phenylacetyl)aminoacetic acid" -HMDB00824 Propionylcarnitine 17298-37-2 C10H19NO4 217.131409 217.262 218.1386854 216.1241326 C03017 "Not Available" InChI=1/C10H19NO4/c1-5-10(14)15-8(6-9(12)13)7-11(2,3)4/h8H,5-7H2,1-4H3 Rumen "Amino acids and Amino Acid conjugates" 3-propanoyloxy-4-trimethylammonio-butanoate -HMDB00826 "Pentadecanoic acid" 1002-84-2 C15H30O2 242.224579 242.398 243.2318554 241.2173026 "Not Available" "Not Available" InChI=1/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17) Rumen "Organic acids" "Pentadecanoic acid" -HMDB00827 "Stearic acid" 57-11-4 C18H36O2 284.271515 284.477 285.2787914 283.2642386 C01530 STEARIC_ACID InChI=1/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20) Rumen "Organic acids" "Octadecanoic acid" -HMDB00863 "Isopropyl alcohol" 67-63-0 C3H8O 60.057514 60.095 61.0647904 59.0502376 "Not available" "Not Available" InChI=1/C3H8O/c1-3(2)4/h3-4H,1-2H3 Rumen Alcohols propan-2-ol -HMDB00870 Histamine 51-45-6 C5H9N3 111.079643 111.145 112.0869194 110.0723666 C00388 HISTAMINE InChI=1/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8) Rumen "Amino acids and Amino Acid conjugates" 2-(3H-imidazol-4-yl)ethanamine -HMDB00883 L-Valine 72-18-4 C5H11NO2 117.078979 117.146 118.0862554 116.0717026 C00183 VAL InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-3-methyl-butanoic acid" -HMDB00885 CE(16:0) 601-34-3 C43H76O2 624.584534 625.062 625.5918104 623.5772576 C11251 Cholesterol-esters InChI=1/C43H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-41(44)45-36-28-30-42(5)35(32-36)24-25-37-39-27-26-38(34(4)22-20-21-33(2)3)43(39,6)31-29-40(37)42/h24,33-34,36-40H,7-23,25-32H2,1-6H3/t34-,36+,37+,38-,39+,40+,42+,43-/m1/s1 Rumen "Cholesterols and derivatives" "[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate" -HMDB00892 "Valeric acid" 109-52-4 C5H10O2 102.068077 102.132 103.0753534 101.0608006 C00803 "Not Available" InChI=1/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7) Rumen "Organic acids" "pentanoic acid" -HMDB00904 Citrulline 372-75-8 C6H13N3O3 175.095688 175.186 176.1029644 174.0884116 C00327 L-CITRULLINE InChI=1/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-5-(carbamoylamino)pentanoic acid" -HMDB00918 CE(18:1(9Z)) 303-43-5 C45H78O2 650.600159 651.100 651.6074354 649.5928826 C14641 Cholesterol-esters InChI=1/C45H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h14-15,26,35-36,38-42H,7-13,16-25,27-34H2,1-6H3/b15-14-/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1 Rumen "Cholesterols and derivatives" "[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate" -HMDB00929 L-Tryptophan 73-22-3 C11H12N2O2 204.089874 204.225 205.0971504 203.0825976 C00078 TRP InChI=1/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 Rumen "Amino acids and Amino Acid conjugates" "(2S)-2-amino-3-(1H-indol-3-yl)propanoic acid" -HMDB00954 "trans-Ferulic acid" 537-98-4 C10H10O4 194.057907 194.184 195.0651834 193.0506306 "Not Available" "Not Available" InChI=1/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ Rumen Alcohols "3-(4-hydroxy-3-methoxyphenyl)-prop-2-enoic acid" -HMDB00958 "trans-Aconitic acid" 4023-65-8 C6H6O6 174.016434 174.108 175.0237104 173.0091576 C02341 CPD-225 InChI=1/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+ Rumen "Organic acids" "(E)-prop-1-ene-1,2,3-tricarboxylic acid" -HMDB01088 Butyryl-CoA 2140-48-9 C25H42N7O17P3S 837.157104 837.624 838.1643804 836.1498276 C00136 CPD-12174 InChI=1/C25H42N7O17P3S/c1-13(2)24(37)53-8-7-27-15(33)5-6-28-22(36)19(35)25(3,4)10-46-52(43,44)49-51(41,42)45-9-14-18(48-50(38,39)40)17(34)23(47-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,17-,18-,19?,23-/m1/s1 Rumen "Nucleosides and Nucleoside conjugates" "[5-(6-aminopurin-9-yl)-2-[[[[3-[2-(2-butanoylsulfanylethylcarbamoyl)ethylcarbamoyl]-3-hydroxy-2,2-dimethyl-propoxy]-hydroxy-phosphoryl]oxy-hydroxy-pho<br>sphoryl]oxymethyl]-4-hydroxy-oxolan-3-yl]oxyphosphonic acid" -HMDB01151 Allose 6038-51-3 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C01487 D-ALLOSE-6-PHOSPHATE InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5-,6?/m0/s1 Rumen "Carbohydrates and Carbohydrate conjugates" 6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB01266 L-Sorbose 87-79-6 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00247 SORBOSE InChI=1/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4+,5-,6+/m0/s1 Rumen "Carbohydrates and Carbohydrate conjugates" 2-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB01311 "D-Lactic acid" 10326-41-7 C3H6O3 90.031693 90.078 91.0389694 89.0244166 C00256 D-LACTATE InChI=1/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m1/s1 Rumen "Organic acids" "(2R)-2-hydroxypropanoic acid" -HMDB01414 Putrescine 110-60-1 C4H12N2 88.100044 88.151 89.1073204 87.0927676 C00134 PUTRESCINE InChI=1/C4H12N2/c5-3-1-2-4-6/h1-6H2 Rumen Amines butane-1,4-diamine -HMDB01429 Phosphate 14265-44-2 [PO4]3- 94.953423 94.971 95.9606994 93.9461466 C00009 CPD-8587 InChI=1/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 Rumen "Inorganic compounds" phosphate -HMDB01488 "Nicotinic acid" 59-67-6 C6H5NO2 123.032028 123.109 124.0393044 122.0247516 C00253 NIACINE InChI=1/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) Rumen "Amino acids and Amino Acid conjugates" "pyridine-3-carboxylic acid" -HMDB01847 Caffeine 58-08-2 C8H10N4O2 194.080383 194.191 195.0876594 193.0731066 C07481 "Not Available" InChI=1/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3 Rumen "Nucleosides and Nucleoside conjugates" 1,3,7-trimethylpurine-2,6-dione -HMDB01873 "Isobutyric acid" 79-31-2 C4H8O2 88.052429 88.105 89.0597054 87.0451526 C02632 ISOBUTANOATE InChI=1/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6) Rumen "Organic acids" "isobutyric acid" -HMDB01882 Dihydroxyacetone 96-26-4 C3H6O3 90.031693 90.078 91.0389694 89.0244166 C00184 1-ACYL-GLYCERONE-3-PHOSPHATE InChI=1/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2 Rumen Alcohols 1,3-dihydroxypropan-2-one -HMDB02005 "Methionine sulfoxide" 62697-73-8 C5H11NO3S 165.045959 165.211 166.0532354 164.0386826 "Not Available" L-METHIONINE_SULFOXIDE InChI=1/C5H11NO3S/c1-10(9)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8) Rumen "Amino acids and Amino Acid conjugates" "2-amino-4-methylsulfinyl-butanoic acid" -HMDB02322 Cadaverine 462-94-2 C5H14N2 102.115700 102.178 103.1229764 101.1084236 C01672 CADAVERINE InChI=1/C5H14N2/c6-4-2-1-3-5-7/h1-7H2 Rumen Amines pentane-1,5-diamine -HMDB02366 Tiglylcarnitine 64191-86-2 C12H21NO4 243.147064 243.299 244.1543404 242.1397876 "Not Available" "Not Available" InChI=1/C12H21NO4/c1-6-9(2)12(16)17-10(7-11(14)15)8-13(3,4)5/h6,10H,7-8H2,1-5H3/b9-6+ Rumen "Amino acids and Amino Acid conjugates" "Not Available" -HMDB03081 Beta-D-Fucose 28161-52-6 C6H12O5 164.068481 164.156 165.0757574 163.0612046 C02095 "Not Available" InChI=1/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (2R,3R,4S,5S,6R)-6-methyloxane-2,3,4,5-tetrol -HMDB03229 "Palmitoleic acid" 373-49-9 C16H30O2 254.224579 254.408 255.2318554 253.2173026 C08362 CPD-724 InChI=1/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2,1H3,(H,17,18)/b8-7- Rumen "Organic acids" "(E)-hexadec-9-enoic acid" -HMDB03339 "D-Glutamic acid" 6893-26-1 C5H9NO4 147.053162 147.129 148.0604384 146.0458856 C00217 GAMMA-GLUTAMYL-D-GLUTAMATE InChI=1/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m1/s1 Rumen "Amino acids and Amino Acid conjugates" "(2R)-2-aminopentanedioic acid" -HMDB03345 Alpha-D-Glucose 492-62-6 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00267 ALPHA-GLUCOSE-16-BISPHOSPHATE InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" alpha-D-glucopyranose -HMDB03418 D-Tagatose 87-81-0 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00795 TAGATOSE InChI=1/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5+,6-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one -HMDB03449 Beta-D-Galactose 7296-64-2 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C00962 ALPHA-N-DIACETYLNEURAMINYL-23-BETA-D-ETC InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB04461 Benzamide 55-21-0 C7H7NO 121.052765 121.137 122.0600414 120.0454886 C09815 SAM InChI=1/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) Rumen "Ketones and Aldehydes" benzamide -HMDB06469 "Linoleyl carnitine" 36816-10-1 C25H45NO4 423.334869 423.629 424.3421454 422.3275926 "Not Available" "Not Available" InChI=1/C25H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3/b10-9-,13-12-/t23-/m1/s1 Rumen "Amino acids and Amino Acid conjugates" "Not Available" -HMDB06725 CE(14:0) 1989-52-2 C41H72O2 596.553223 597.009 597.5604994 595.5459466 "Not Available" "Not Available" InChI=1/C41H72O2/c1-7-8-9-10-11-12-13-14-15-16-17-21-39(42)43-34-26-28-40(5)33(30-34)22-23-35-37-25-24-36(32(4)20-18-19-31(2)3)41(37,6)29-27-38(35)40/h22,31-32,34-38H,7-21,23-30H2,1-6H3/t32-,34+,35+,36-,37+,38+,40+,41-/m1/s1 Rumen "Cholesterols and derivatives" 1-tetradecanoyl-cholesterol -HMDB06727 CE(22:0) 61510-09-6 C49H88O2 708.678406 709.222 709.6856824 707.6711296 C02530 Cholesterol-esters InChI=1/C49H88O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-47(50)51-42-34-36-48(5)41(38-42)30-31-43-45-33-32-44(40(4)28-26-27-39(2)3)49(45,6)37-35-46(43)48/h30,39-40,42-46H,7-29,31-38H2,1-6H3/t40-,42+,43?,44?,45?,46?,48+,49-/m1/s1 Rumen "Cholesterols and derivatives" 1-docosanoyl-cholesterol -HMDB06740 CE(20:0) 2573-03-7 C47H84O2 680.647156 681.169 681.6544324 679.6398796 C02530 Cholesterol-esters InChI=1/C47H84O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h28,37-38,40-44H,7-27,29-36H2,1-6H3/t38-,40+,41?,42?,43?,44?,46+,47-/m1/s1 Rumen "Cholesterols and derivatives" 1-eicosanoyl-cholesterol -HMDB06857 Dextrin 9004-53-9 C18H32O16 504.169037 504.437 505.1763134 503.1617606 C00721 "Not Available" InChI=1/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16+,17?,18?/m1/s1 Rumen "Carbohydrates and Carbohydrate conjugates" "sodium (2-hydroxy-3-octadec-9-enoyloxypropyl) hydrogen phosphate" -HMDB10169 SM(d18:1/16:0) "Not Available" C39H80N2O6P 703.575378 704.036 704.5826544 702.5681016 C00550 "Not Available" InChI=1/C39H79N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h30,32,37-38,42H,6-29,31,33-36H2,1-5H3,(H-,40,43,44,45)/p+1/b32-30+/t37-,38+/m0/s1 Rumen Lipids 2-[[(E,2S,3R)-2-(hexadecanoylamino)-3-hydroxyoctadec-4-enoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium -HMDB10368 CE(18:0) "Not Available" C45H80O2 652.615845 653.115 653.6231214 651.6085686 C02530 Cholesterol-esters InChI=1/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39?,40?,41?,42?,44+,45-/m1/s1 Rumen "Cholesterols and derivatives" 1-octadecanoyl-cholesterol -HMDB10372 CE(22:1(13Z)) "Not Available" C49H86O2 706.662781 707.206 707.6700574 705.6555046 "Not Available" "Not Available" InChI=1/C49H86O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-47(50)51-42-34-36-48(5)41(38-42)30-31-43-45-33-32-44(40(4)28-26-27-39(2)3)49(45,6)37-35-46(43)48/h14-15,30,39-40,42-46H,7-13,16-29,31-38H2,1-6H3/b15-14-/t40-,42+,43?,44?,45?,46?,48+,49-/m1/s1 Rumen "Cholesterols and derivatives" 1-(13Z-docosenoyl)-cholesterol -HMDB10376 CE(24:0) "Not Available" C51H92O2 736.709717 737.275 737.7169934 735.7024406 "Not Available" "Not Available" InChI=1/C51H92O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31-49(52)53-44-36-38-50(5)43(40-44)32-33-45-47-35-34-46(42(4)30-28-29-41(2)3)51(47,6)39-37-48(45)50/h32,41-42,44-48H,7-31,33-40H2,1-6H3/t42-,44+,45?,46?,47?,48?,50+,51-/m1/s1 Rumen "Cholesterols and derivatives" 1-tetracosanoyl-cholesterol -HMDB10383 LysoPC(16:1(9Z)) "Not Available" C24H48NO7P 493.316833 493.614 494.3241094 492.3095566 C04230 PHOSPHATIDYLCHOLINE InChI=1/C24H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h10-11,23,26H,5-9,12-22H2,1-4H3/b11-10-/t23-/m1/s1 Rumen Lipids 1-(9Z-hexadecenoyl)-glycero-3-phosphocholine -HMDB10384 LysoPC(18:0) "Not Available" C26H54NO7P 523.363770 523.683 524.3710464 522.3564936 C04230 PHOSPHATIDYLCHOLINE InChI=1/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1 Rumen Lipids 1-octadecanoyl-glycero-3-phosphocholine -HMDB10385 LysoPC(18:1(11Z)) "Not Available" C26H52NO7P 521.348145 521.667 522.3554214 520.3408686 C04230 PHOSPHATIDYLCHOLINE InChI=1/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h10-11,25,28H,5-9,12-24H2,1-4H3/b11-10-/t25-/m1/s1 Rumen Lipids 1-(11Z-octadecenoyl)-glycero-3-phosphocholine -HMDB10386 LysoPC(18:2(9Z,12Z)) "Not Available" C26H50NO7P 519.332520 519.651 520.3397964 518.3252436 C04230 PHOSPHATIDYLCHOLINE InChI=1/C26H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h9-10,12-13,25,28H,5-8,11,14-24H2,1-4H3/b10-9-,13-12-/t25-/m1/s1 Rumen Lipids 1-(9Z,12Z-octadecadienoyl)-glycero-3-phosphocholine -HMDB10395 LysoPC(20:4(5Z,8Z,11Z,14Z)) "Not Available" C28H50NO7P 543.332520 543.673 544.3397964 542.3252436 C04230 PHOSPHATIDYLCHOLINE InChI=1/C28H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h9-10,12-13,15-16,18-19,27,30H,5-8,11,14,17,20-26H2,1-4H3/b10-9-,13-12-,16-15-,19-18-/t27-/m1/s1 Rumen Lipids 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-glycero-3-phosphocholine -HMDB12107 SM(d18:1/24:1(15Z)) "Not Available" C47H93N2O6P 812.677124 813.225 813.6844004 811.6698476 C00550 "Not Available" InChI=1/C47H93N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h20-21,38,40,45-46,50H,6-19,22-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b21-20-,40-38+/t45-,46+/m0/s1 Rumen Lipids 2-[hydroxy-[(E,2S,3R)-3-hydroxy-2-[[(Z)-tetracos-15-enoyl]amino]octadec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium -HMDB12108 LysoPC(17:0) "Not Available" C25H52NO7P 509.348145 509.657 510.3554214 508.3408686 C04230 "Not Available" InChI=1/C25H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)31-22-24(27)23-33-34(29,30)32-21-20-26(2,3)4/h24,27H,5-23H2,1-4H3/t24-/m1/s1 Rumen Lipids 1-margaroyl-glycero-3-phosphocholine -HMDB12275 Phenylethylamine 64-04-0 C8H11N 121.089149 121.180 122.0964254 120.0818726 C05332 PHENYLETHYLAMINE InChI=1/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2 Rumen "Not Available" 2-phenylethanamine -HMDB12326 L-Gulose 6027-89-0 C6H12O6 180.063385 180.156 181.0706614 179.0561086 C15923 CPD4FS-6 InChI=1/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5-,6u/m0/s1 Rumen "Carbohydrates and Carbohydrate conjugates" (3S,4S,5S,6S)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol -HMDB13125 Hydroxypropionylcarnitine "Not Available" C10H19NO5 233.126328 233.262 234.1336044 232.1190516 "Not Available" "Not Available" InChI=1/C10H19NO5/c1-11(2,3)7-8(6-9(13)14)16-10(15)4-5-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13126 Butenylcarnitine "Not Available" C11H19NO4 229.131409 229.273 230.1386854 228.1241326 "Not Available" "Not Available" InChI=1/C11H19NO4/c1-5-6-11(15)16-9(7-10(13)14)8-12(2,3)4/h5-6,9H,7-8H2,1-4H3/b6-5+/t9-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13127 Hydroxybutyrylcarnitine "Not Available" C11H21NO5 247.141968 247.288 248.1492444 246.1346916 "Not Available" "Not Available" InChI=1/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3/t8?,9-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13128 Valerylcarnitine "Not Available" C12H23NO4 245.162704 245.315 246.1699804 244.1554276 "Not Available" "Not Available" InChI=1/C12H23NO4/c1-5-6-7-12(16)17-10(8-11(14)15)9-13(2,3)4/h10H,5-9H2,1-4H3/t10-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13129 Glutaconylcarnitine "Not Available" C12H19NO6 273.121246 273.282 274.1285224 272.1139696 "Not Available" "Not Available" InChI=1/C12H19NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h4,6,9H,5,7-8H2,1-3H3,(H-,14,15,16,17)/b6-4+/t9-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13133 Methylglutarylcarnitine "Not Available" C11H19NO6 261.121246 261.272 262.1285224 260.1139696 "Not Available" "Not Available" InChI=1/C11H19NO6/c1-7(10(15)16)11(17)18-8(5-9(13)14)6-12(2,3)4/h7-8H,5-6H2,1-4H3,(H-,13,14,15,16)/t7?,8-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13161 2-Hexenoylcarnitine "Not Available" C13H23NO4 257.162720 257.326 258.1699964 256.1554436 "Not Available" "Not Available" InChI=1/C13H23NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h7-8,11H,5-6,9-10H2,1-4H3/b8-7+ Rumen "Not Available" "Not Available" -HMDB13328 Pimelylcarnitine "Not Available" C14H25NO6 303.168182 303.351 304.1754584 302.1609056 "Not Available" "Not Available" InChI=1/C14H25NO6/c1-15(2,3)11(9-10-13(18)19)21-14(20)8-6-4-5-7-12(16)17/h11H,4-10H2,1-3H3,(H-,16,17,18,19)/t11-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13334 9,12-Hexadecadienoylcarnitine "Not Available" C23H41NO4 395.303558 395.576 396.3108344 394.2962816 "Not Available" "Not Available" InChI=1/C23H41NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(24(2,3)4)19-20-22(25)26/h7-8,10-11,21H,5-6,9,12-20H2,1-4H3/b8-7-,11-10-/t21-/m0/s1 Rumen "Not Available" "Not Available" -HMDB13462 SM(d18:0/14:1(9Z)(OH)) "Not Available" C37H73N2O7P 688.515564 688.958 689.5228404 687.5082876 C00550 "Not Available" InChI=1/C37H73N2O7P/c1-6-8-10-12-14-16-17-18-19-21-23-25-27-29-36(41)35(33-46-47(43,44)45-31-30-39(3,4)5)38-37(42)32-34(40)28-26-24-22-20-15-13-11-9-7-2/h13,15,27,29,34-36,40-41H,6-12,14,16-26,28,30-33H2,1-5H3,(H-,38,42,43,44)/b15-13-,29-27+/t34?,35-,36+/m0/s1 Rumen Lipids "Not Available" -HMDB13463 SM(d18:0/16:1(9Z)(OH)) "Not Available" C39H77N2O7P 716.546814 717.012 717.5540904 715.5395376 C00550 "Not Available" InChI=1/C39H77N2O7P/c1-6-8-10-12-14-16-18-19-21-23-25-27-29-31-38(43)37(35-48-49(45,46)47-33-32-41(3,4)5)40-39(44)34-36(42)30-28-26-24-22-20-17-15-13-11-9-7-2/h17,20,29,31,36-38,42-43H,6-16,18-19,21-28,30,32-35H2,1-5H3,(H-,40,44,45,46)/b20-17-,31-29+/t36?,37-,38+/m0/s1 Rumen Lipids "Not Available" -HMDB13464 SM(d18:0/16:1(9Z)) "Not Available" C39H79N2O6P 702.567566 703.028 703.5748424 701.5602896 C00550 "Not Available" InChI=1/C39H79N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,37-38,42H,6-16,18,20-36H2,1-5H3,(H-,40,43,44,45)/b19-17-/t37-,38+/m0/s1 Rumen Lipids "Not Available" -HMDB13465 SM(d18:0/20:2(11Z,14Z)) "Not Available" C43H83N2O6P 754.598877 755.103 755.6061534 753.5916006 C00550 "Not Available" InChI=1/C43H83N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h14,16,20-21,34,36,41-42,46H,6-13,15,17-19,22-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b16-14-,21-20-,36-34+/t41-,42+/m0/s1 Rumen Lipids "Not Available" -HMDB13466 SM(d18:0/22:1(13Z)(OH)) "Not Available" C45H89N2O7P 800.640747 801.171 801.6480234 799.6334706 C00550 "Not Available" InChI=1/C45H89N2O7P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-36-42(48)40-45(50)46-43(41-54-55(51,52)53-39-38-47(3,4)5)44(49)37-35-33-31-29-27-24-19-17-15-13-11-9-7-2/h20-21,35,37,42-44,48-49H,6-19,22-34,36,38-41H2,1-5H3,(H-,46,50,51,52)/b21-20-,37-35+/t42?,43-,44+/m0/s1 Rumen Lipids "Not Available" -HMDB13467 SM(d18:0/22:2(13Z,16Z)(OH)) "Not Available" C45H87N2O7P 798.625061 799.155 799.6323374 797.6177846 C00550 "Not Available" InChI=1/C45H87N2O7P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-36-42(48)40-45(50)46-43(41-54-55(51,52)53-39-38-47(3,4)5)44(49)37-35-33-31-29-27-24-19-17-15-13-11-9-7-2/h14,16,20-21,35,37,42-44,48-49H,6-13,15,17-19,22-34,36,38-41H2,1-5H3,(H-,46,50,51,52)/b16-14-,21-20-,37-35+/t42?,43-,44+/m0/s1 Rumen Lipids "Not Available" -HMDB13468 SM(d18:0/22:3(10Z,13Z,16Z)) "Not Available" C45H85N2O6P 780.614502 781.140 781.6217784 779.6072256 C00550 "Not Available" InChI=1/C45H85N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-45(49)46-43(42-53-54(50,51)52-41-40-47(3,4)5)44(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h14,16,20-21,23-24,36,38,43-44,48H,6-13,15,17-19,22,25-35,37,39-42H2,1-5H3,(H-,46,49,50,51)/b16-14-,21-20-,24-23-,38-36+/t43-,44+/m0/s1 Rumen Lipids "Not Available" -HMDB13469 SM(d18:0/24:1(15Z)(OH)) "Not Available" C47H93N2O7P 828.672058 829.224 829.6793344 827.6647816 C00550 "Not Available" InChI=1/C47H93N2O7P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-28-30-32-34-36-38-44(50)42-47(52)48-45(43-56-57(53,54)55-41-40-49(3,4)5)46(51)39-37-35-33-31-29-26-19-17-15-13-11-9-7-2/h20-21,37,39,44-46,50-51H,6-19,22-36,38,40-43H2,1-5H3,(H-,48,52,53,54)/b21-20-,39-37+/t44?,45-,46+/m0/s1 Rumen Lipids "Not Available"
--- a/test-data/out03.tabular Tue Jan 21 16:09:45 2020 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,1234 +0,0 @@ -HMDB_ID MzBank MetName ChemFormula INChIkey -HMDB0000001 169.085126611 1-Methylhistidine C7H11N3O2 BRMWTNUJHUMWMS-LURJTMIESA-N -HMDB0000005 102.031694058 "2-Ketobutyric acid" C4H6O3 TYEYBOSBBBHJIV-UHFFFAOYSA-N -HMDB0000008 104.047344122 "2-Hydroxybutyric acid" C4H8O3 AFENDNXGAFYKQO-UHFFFAOYSA-N -HMDB0000017 183.053157781 "4-Pyridoxic acid" C8H9NO4 HXACOUQIXZGNBF-UHFFFAOYSA-N -HMDB0000019 116.047344122 "alpha-Ketoisovaleric acid" C5H8O3 QHKABHOOEWYVLI-UHFFFAOYSA-N -HMDB0000020 152.047344122 "p-Hydroxyphenylacetic acid" C8H8O3 XQXPVVBIMDBYFF-UHFFFAOYSA-N -HMDB0000023 104.047344122 "(S)-3-Hydroxyisobutyric acid" C4H8O3 DBXBTMSZEOQQDU-VKHMYHEASA-N -HMDB0000030 244.088163078 Biotin C10H16N2O3S YBJHBAHKTGYVGT-ZKWXMUAHSA-N -HMDB0000033 226.106590334 Carnosine C9H14N4O3 CQOVPNPJLQNMDC-ZETCQYMHSA-N -HMDB0000034 135.054495185 Adenine C5H5N5 GFFGJBXGBJISGV-UHFFFAOYSA-N -HMDB0000037 360.193674006 Aldosterone C21H28O5 PQSUYGKTWSAVDQ-SRPWZAMTSA-N -HMDB0000038 239.101839307 Dihydrobiopterin C9H13N5O3 FEMXZDUTFRTWPE-UHFFFAOYSA-N -HMDB0000039 88.0524295 "Butyric acid" C4H8O2 FERIUCNNQQJTOY-UHFFFAOYSA-N -HMDB0000042 60.021129372 "Acetic acid" C2H4O2 QTBSBXVTEAMEQO-UHFFFAOYSA-N -HMDB0000043 117.078978601 Betaine C5H11NO2 KWIUHFFTVRNATP-UHFFFAOYSA-N -HMDB0000044 176.032087988 "Ascorbic acid" C6H8O6 CIWBSHSKHKDKBQ-JLAZNSOCSA-N -HMDB0000045 347.063084339 "Adenosine monophosphate" C10H14N5O7P UDMBCSSLTHHNCD-KQYNXXCUSA-N -HMDB0000050 267.096753929 Adenosine C10H13N5O4 OIRDTQYFTABQOQ-KQYNXXCUSA-N -HMDB0000056 89.047678473 beta-Alanine C3H7NO2 UCMIRNVEIXFBKS-UHFFFAOYSA-N -HMDB0000060 102.031694058 "Acetoacetic acid" C4H6O3 WDJHALXBUFZDSR-UHFFFAOYSA-N -HMDB0000062 161.105193351 L-Carnitine C7H15NO3 PHIQHXFUZVPYII-ZCFIWIBFSA-N -HMDB0000063 362.20932407 Cortisol C21H30O5 JYGXADMDTFJGBT-VWUMJDOOSA-N -HMDB0000064 131.069476547 Creatine C4H9N3O2 CVSVTCORWBXHQV-UHFFFAOYSA-N -HMDB0000067 386.354866094 Cholesterol C27H46O HVYWMOMLDIMFJA-DPAQBDIFSA-N -HMDB0000070 129.078978601 "Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-UHFFFAOYSA-N -HMDB0000071 252.085854882 Deoxyinosine C10H12N4O4 VGONTNSXDCQUGY-RRKCRQDMSA-N -HMDB0000072 174.016437924 "cis-Aconitic acid" C6H6O6 GTZCVFVGUGFEME-IWQZZHSRSA-N -HMDB0000076 114.042927446 Dihydrouracil C4H6N2O2 OIVLITBTBDPEFK-UHFFFAOYSA-N -HMDB0000077 288.20893014 Dehydroepiandrosterone C19H28O2 FMGSKLZLMKYGDP-USOAJAOKSA-N -HMDB0000078 178.041212886 Cysteinylglycine C5H10N2O3S ZUKPVRWZDMRIEO-VKHMYHEASA-N -HMDB0000079 128.05857751 Dihydrothymine C5H8N2O2 NBAKTGXDIBVZOO-UHFFFAOYSA-N -HMDB0000085 267.096753929 Deoxyguanosine C10H13N5O4 YKBGVTZYEHREMT-KVQBGUIXSA-N -HMDB0000086 257.102823889 Glycerophosphocholine C8H20NO6P SUHOQUVVVLNYQR-QMMMGPOBSA-N -HMDB0000087 45.057849229 Dimethylamine C2H7N ROSDSFDQCJNGOL-UHFFFAOYSA-N -HMDB0000089 243.085520541 Cytidine C9H13N3O5 UHDGCWIWMRVCDJ-XVFCMESISA-N -HMDB0000092 103.063328537 Dimethylglycine C4H9NO2 FFDGPVCHZBVARC-UHFFFAOYSA-N -HMDB0000094 192.02700261 "Citric acid" C6H8O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N -HMDB0000095 323.051850951 "Cytidine monophosphate" C9H14N3O8P IERHLVCPSMICTF-XVFCMESISA-N -HMDB0000097 104.107539075 Choline C5H14NO OEYIOHPDSNJKLS-UHFFFAOYSA-N -HMDB0000098 150.05282343 D-Xylose C5H10O5 SRBFZHDQGSBBOR-IOVATXLUSA-N -HMDB0000107 182.07903818 Galactitol C6H14O6 FBPFZTCFMRRESA-GUCUJZIJSA-N -HMDB0000108 46.041864814 Ethanol C2H6O LFQSCWFLJHTTHZ-UHFFFAOYSA-N -HMDB0000112 103.063328537 "gamma-Aminobutyric acid" C4H9NO2 BTCSSZJGUNDROE-UHFFFAOYSA-N -HMDB0000115 76.016043994 "Glycolic acid" C2H4O3 AEMRFAOFKBGASW-UHFFFAOYSA-N -HMDB0000118 182.057908808 "Homovanillic acid" C9H10O4 QRMZSPFSDQBLIX-UHFFFAOYSA-N -HMDB0000122 180.063388116 D-Glucose C6H12O6 WQZGKKKJIJFFOK-GASJEMHNSA-N -HMDB0000123 75.032028409 Glycine C2H5NO2 DHMQDGOQFOQNFH-UHFFFAOYSA-N -HMDB0000124 260.029718526 "Fructose 6-phosphate" C6H13O9P GSXOAOHZAIYLCY-HSUXUTPPSA-N -HMDB0000125 307.083805981 Glutathione C10H17N3O6S RWSXRVCMGQZWBV-WDSKDSINSA-N -HMDB0000126 172.013674532 "Glycerol 3-phosphate" C3H9O6P AWUCVROLDVIAJX-GSVOUGTGSA-N -HMDB0000131 92.047344122 Glycerol C3H8O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N -HMDB0000132 151.049409807 Guanine C5H5N5O UYTPUPDQBNUYGX-UHFFFAOYSA-N -HMDB0000133 283.091668551 Guanosine C10H13N5O5 NYHBQMYGNKIUIF-UUOKFMHZSA-N -HMDB0000134 116.010958616 "Fumaric acid" C4H4O4 VZCYOOQTPOCHFL-OWOJBTEDSA-N -HMDB0000139 106.02660868 "Glyceric acid" C3H6O4 RBNPOMFGQQGHHO-UWTATZPHSA-N -HMDB0000142 46.005479308 "Formic acid" CH2O2 BDAGIHXWWSANSR-UHFFFAOYSA-N -HMDB0000143 180.063388116 D-Galactose C6H12O6 WQZGKKKJIJFFOK-PHYPRBDBSA-N -HMDB0000148 147.053157781 "L-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-VKHMYHEASA-N -HMDB0000149 61.052763851 Ethanolamine C2H7NO HZAXFHJVJLSVMW-UHFFFAOYSA-N -HMDB0000151 272.177630012 Estradiol C18H24O2 VOXZDWNPVJITMN-ZBRFXRBCSA-N -HMDB0000156 134.021523302 "L-Malic acid" C4H6O5 BJEPYKJPYRNKOW-REOHCLBHSA-N -HMDB0000157 136.03851077 Hypoxanthine C5H4N4O FDGQSTZJBFJUBT-UHFFFAOYSA-N -HMDB0000158 181.073893223 L-Tyrosine C9H11NO3 OUYCCCASQSFEME-QMMMGPOBSA-N -HMDB0000159 165.078978601 L-Phenylalanine C9H11NO2 COLNVLDHVKWLRT-QMMMGPOBSA-N -HMDB0000161 89.047678473 L-Alanine C3H7NO2 QNAYBMKLOCPYGJ-REOHCLBHSA-N -HMDB0000162 115.063328537 L-Proline C5H9NO2 ONIBWKKTOPOVIA-BYPYZUCNSA-N -HMDB0000164 31.042199165 Methylamine CH5N BAVYZALUXZFZLV-UHFFFAOYSA-N -HMDB0000167 119.058243159 L-Threonine C4H9NO3 AYFVYJQAPQTCCC-GBXIJSLDSA-N -HMDB0000168 132.053492132 L-Asparagine C4H8N2O3 DCXYFEDJOCDNAF-REOHCLBHSA-N -HMDB0000169 180.063388116 D-Mannose C6H12O6 WQZGKKKJIJFFOK-QTVWNMPRSA-N -HMDB0000172 131.094628665 L-Isoleucine C6H13NO2 AGPKZVBTJJNPAG-WHFBIAKZSA-N -HMDB0000174 164.068473494 L-Fucose C6H12O5 SHZGCJCMOBCMKK-DHVFOXMCSA-N -HMDB0000177 155.069476547 L-Histidine C6H9N3O2 HNDVDQJCIGZPNO-YFKPBYRVSA-N -HMDB0000182 146.105527702 L-Lysine C6H14N2O2 KDXKERNSBIXSRK-YFKPBYRVSA-N -HMDB0000187 105.042593095 L-Serine C3H7NO3 MTCFGRXMJLQNBG-REOHCLBHSA-N -HMDB0000190 90.031694058 "L-Lactic acid" C3H6O3 JVTAAEKCZFNVCJ-REOHCLBHSA-N -HMDB0000191 133.037507717 "L-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-REOHCLBHSA-N -HMDB0000193 192.02700261 "Isocitric acid" C6H8O7 ODBLHEXUDAPZAU-UHFFFAOYSA-N -HMDB0000194 240.122240398 Anserine C10H16N4O3 MYYIAHXIVFADCU-QMMMGPOBSA-N -HMDB0000195 268.080769514 Inosine C10H12N4O5 UGQMRVRMYYASKQ-KQYNXXCUSA-N -HMDB0000197 175.063328537 "Indoleacetic acid" C10H9NO2 SEOVTRFCIGRIMH-UHFFFAOYSA-N -HMDB0000201 203.115758031 L-Acetylcarnitine C9H17NO4 RDHQFKQIGNGIED-MRVPVSSYSA-N -HMDB0000206 188.116092388 N6-Acetyl-L-lysine C8H16N2O3 DTERQYGMUDWYAZ-ZETCQYMHSA-N -HMDB0000207 282.255880332 "Oleic acid" C18H34O2 ZQPPMHVWECSIRJ-KTKRTIGZSA-N -HMDB0000208 146.021523302 "Oxoglutaric acid" C5H6O5 KPGXRSRHYNQIFN-UHFFFAOYSA-N -HMDB0000209 136.0524295 "Phenylacetic acid" C8H8O2 WLJVXDMOQOGPHL-UHFFFAOYSA-N -HMDB0000210 219.110672659 "Pantothenic acid" C9H17NO5 GHOKWGTUZJEAQD-ZETCQYMHSA-N -HMDB0000211 180.063388116 myo-Inositol C6H12O6 CDAISMWEOUEBRE-GPIVLXJGSA-N -HMDB0000212 221.089937217 N-Acetylgalactosamine C8H15NO6 OVRNDRQMDRJTHS-CBQIKETKSA-N -HMDB0000213 260.029718526 "Myo-inositol 1-phosphate" C6H13O9P INAPMGSXUVUWAF-PTQMNWPWSA-N -HMDB0000214 132.089877638 Ornithine C5H12N2O2 AHLPHDHHMVZTML-BYPYZUCNSA-N -HMDB0000215 221.089937217 N-Acetyl-D-glucosamine C8H15NO6 OVRNDRQMDRJTHS-RTRLPJTCSA-N -HMDB0000220 256.240230268 "Palmitic acid" C16H32O2 IPCSVZSSVZVIGE-UHFFFAOYSA-N -HMDB0000222 399.334858933 L-Palmitoylcarnitine C23H45NO4 XOMRRQXKHMYMOC-OAQYLSRUSA-N -HMDB0000224 141.019094261 O-Phosphoethanolamine C2H8NO4P SUHOOTKUPISOBE-UHFFFAOYSA-N -HMDB0000226 156.017106626 "Orotic acid" C5H4N2O4 PXQPEWDEAKTCGB-UHFFFAOYSA-N -HMDB0000228 94.041864814 Phenol C6H6O ISWSIDIOOBJBQZ-UHFFFAOYSA-N -HMDB0000230 309.105981211 "N-Acetylneuraminic acid" C11H19NO9 SQVRNKJHWKZAKO-PFQGKNLYSA-N -HMDB0000234 288.20893014 Testosterone C19H28O2 MUMGGOZAMZWBJJ-DYKIIFRCSA-N -HMDB0000235 265.112306876 Thiamine C12H17N4OS JZRWCGZRTZMZEH-UHFFFAOYSA-N -HMDB0000237 74.036779436 "Propionic acid" C3H6O2 XBDQKXXYIPTUBI-UHFFFAOYSA-N -HMDB0000243 88.016043994 "Pyruvic acid" C3H4O3 LCTONWCANYUPML-UHFFFAOYSA-N -HMDB0000244 376.138284392 Riboflavin C17H20N4O6 AUNGANRZJHBGPY-SCRDCRAPSA-N -HMDB0000247 182.07903818 Sorbitol C6H14O6 FBPFZTCFMRRESA-JGWLITMVSA-N -HMDB0000248 776.686681525 Thyroxine C15H11I4NO4 XUIIKFGFIJCVMT-LBPRGKRZSA-N -HMDB0000250 177.943225506 Pyrophosphate H4O7P2 XPPKVPWEQAFLFU-UHFFFAOYSA-N -HMDB0000251 125.014663785 Taurine C2H7NO3S XOAAWQZATWQOTB-UHFFFAOYSA-N -HMDB0000254 118.02660868 "Succinic acid" C4H6O4 KDYFGRWQOYBRFD-UHFFFAOYSA-N -HMDB0000258 342.116211546 Sucrose C12H22O11 CZMRCDWAGMRECN-UGDNZRGBSA-N -HMDB0000262 126.042927446 Thymine C5H6N2O2 RWQNBRDOKXIBIV-UHFFFAOYSA-N -HMDB0000263 167.982374404 "Phosphoenolpyruvic acid" C3H5O6P DTBNBXWJWCWCIK-UHFFFAOYSA-N -HMDB0000265 650.790038137 Liothyronine C15H12I3NO4 AUYYCJSJGJYCDS-LBPRGKRZSA-N -HMDB0000267 129.042593095 "Pyroglutamic acid" C5H7NO3 ODHCTXKNWHHXJC-VKHMYHEASA-N -HMDB0000271 89.047678473 Sarcosine C3H7NO2 FSYKKLYZXJSNPZ-UHFFFAOYSA-N -HMDB0000273 242.090271568 Thymidine C10H14N2O5 IQFYYKKMVGJFEH-XLPZGREQSA-N -HMDB0000283 150.05282343 D-Ribose C5H10O5 HMFHBZSHGGEWLO-SOOFDHNKSA-N -HMDB0000285 483.968527356 "Uridine triphosphate" C9H15N2O15P3 PGAVKCOVUIYSFO-XVFCMESISA-N -HMDB0000288 324.035866536 "Uridine 5'-monophosphate" C9H13N2O9P DJJCXFVJDGTHFX-XVFCMESISA-N -HMDB0000289 168.028340014 "Uric acid" C5H4N4O3 LEHOTFFKMJEONL-UHFFFAOYSA-N -HMDB0000290 607.081569477 "Uridine diphosphate-N-acetylglucosamine" C17H27N3O17P2 LFTYTUAZOPRMMI-CFRASDGPSA-N -HMDB0000291 198.05282343 "Vanillylmandelic acid" C9H10O5 CGQCWMIAEPEHNQ-QMMMGPOBSA-N -HMDB0000292 152.033425392 Xanthine C5H4N4O2 LRFVTYWOQMYALW-UHFFFAOYSA-N -HMDB0000294 60.03236276 Urea CH4N2O XSQUKJJJFZCRTK-UHFFFAOYSA-N -HMDB0000300 112.027277382 Uracil C4H4N2O2 ISAKRJDGNUQOIC-UHFFFAOYSA-N -HMDB0000301 138.042927446 "Urocanic acid" C6H6N2O2 LOIYMIARKYCTBW-OWOJBTEDSA-N -HMDB0000305 286.229665582 "Vitamin A" C20H30O FPIPGXGPPPQFEQ-OVSJKPMPSA-N -HMDB0000308 374.282095082 "3b-Hydroxy-5-cholenoic acid" C24H38O3 HIAJCGFYHIANNA-QIZZZRFXSA-N -HMDB0000317 132.07864425 "2-Hydroxy-3-methylpentanoic acid" C6H12O3 RILPIWOPNGRASR-RFZPGFLSSA-N -HMDB0000355 162.05282343 "3-Hydroxymethylglutaric acid" C6H10O5 NPOAOTPXWNWTSH-UHFFFAOYSA-N -HMDB0000357 104.047344122 "3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-UHFFFAOYSA-N -HMDB0000374 330.219494826 17-Hydroxyprogesterone C21H30O3 DBPWSSGDRRHUNT-CEGNMAFCSA-N -HMDB0000402 176.068473494 "2-Isopropylmalic acid" C7H12O5 BITYXLXUCSKTJS-ZETCQYMHSA-N -HMDB0000407 118.062994186 "2-Hydroxy-3-methylbutyric acid" C5H10O3 NGEWQZIDQIYUNV-UHFFFAOYSA-N -HMDB0000426 148.037173366 "Citramalic acid" C5H8O5 XFTRTWQBIOMVPK-UHFFFAOYSA-N -HMDB0000440 152.047344122 "3-Hydroxyphenylacetic acid" C8H8O3 FVMDYYGIDFPZAX-UHFFFAOYSA-N -HMDB0000448 146.057908808 "Adipic acid" C6H10O4 WNLRTRBMVRJNCN-UHFFFAOYSA-N -HMDB0000462 158.043990078 Allantoin C4H6N4O3 POJWUDADGALRAB-UHFFFAOYSA-N -HMDB0000464 39.962591155 Calcium Ca BHPQYMZQTOCNFJ-UHFFFAOYSA-N -HMDB0000466 131.073499293 3-Methylindole C9H9N ZFRKQXVRDFCRJG-UHFFFAOYSA-N -HMDB0000474 72.057514878 Butanone C4H8O ZWEHNKRNPOVVGH-UHFFFAOYSA-N -HMDB0000479 169.085126611 3-Methylhistidine C7H11N3O2 JDHILDINMRGULE-LURJTMIESA-N -HMDB0000482 144.115029756 "Caprylic acid" C8H16O2 WWZKQHOCKIZLMA-UHFFFAOYSA-N -HMDB0000484 168.042258738 "Vanillic acid" C8H8O4 WKOLLVMJNQIZCI-UHFFFAOYSA-N -HMDB0000491 130.062994186 "3-Methyl-2-oxovaleric acid" C6H10O3 JVQYSWDUAOAHFM-UHFFFAOYSA-N -HMDB0000492 34.968852707 "Chloride ion" Cl VEXZGXHMUGYJMC-UHFFFAOYSA-M -HMDB0000500 138.031694053 "4-Hydroxybenzoic acid" C7H6O3 FJKROLUGYXJWQN-UHFFFAOYSA-N -HMDB0000510 161.068807845 "Aminoadipic acid" C6H11NO4 OYIFNHCXNCRBQI-UHFFFAOYSA-N -HMDB0000511 172.146329884 "Capric acid" C10H20O2 GHVNFZFCNZKVNT-UHFFFAOYSA-N -HMDB0000512 207.089543287 N-Acetyl-L-phenylalanine C11H13NO3 CBQJSKKFNMDLON-JTQLQIEISA-N -HMDB0000516 180.063388116 Beta-D-Glucose C6H12O6 WQZGKKKJIJFFOK-VFUOTHLCSA-N -HMDB0000517 174.111675712 L-Arginine C6H14N4O2 ODKSFYDXXFIFQN-BYPYZUCNSA-N -HMDB0000532 117.042593095 Acetylglycine C4H7NO3 OKJIRPAQVSHGFK-UHFFFAOYSA-N -HMDB0000535 116.083729628 "Caproic acid" C6H12O2 FUZZWVXGSFPDMH-UHFFFAOYSA-N -HMDB0000538 506.995745159 "Adenosine triphosphate" C10H16N5O13P3 ZKHQWZAMYRWXGA-KQYNXXCUSA-N -HMDB0000539 166.047738052 "Arabinonic acid" C5H10O6 QXKAIJAYHKCRRA-JJYYJPOSSA-N -HMDB0000547 23.985041898 Magnesium Mg JLVVSXFLKOJNIY-UHFFFAOYSA-N -HMDB0000552 289.152537473 3-Methylglutarylcarnitine C13H23NO6 HFCPFJNSBPQJDP-UHFFFAOYSA-N -HMDB0000562 113.058911861 Creatinine C4H7N3O DDRJAANPRJIHGJ-UHFFFAOYSA-N -HMDB0000564 733.562155053 PC(16:0/16:0) C40H80NO8P KILNVBDSWZSGLL-KXQOOQHDSA-N -HMDB0000574 121.019749163 L-Cysteine C3H7NO2S XUJNEKJLAYXESH-REOHCLBHSA-N -HMDB0000586 38.963706861 Potassium K NPYPAHLBTDXSSS-UHFFFAOYSA-N -HMDB0000588 22.989769675 Sodium Na FKNQFGJONOIPTF-UHFFFAOYSA-N -HMDB0000593 785.593455181 "PC(18:1(9Z)/18:1(9Z)) " C44H84NO8P SNKAWJBJQDLSFF-YEUCEMRASA-N -HMDB0000599 51.940511904 Chromium Cr BFGKITSFLPAWGI-UHFFFAOYSA-N -HMDB0000606 148.037173366 "D-2-Hydroxyglutaric acid" C5H8O5 HWXBTNAVRSUOJR-GSVOUGTGSA-N -HMDB0000608 58.933200194 Cobalt Co XLJKHNWPARRRJB-UHFFFAOYSA-N -HMDB0000613 136.037173366 "Erythronic acid" C4H8O5 JPIJQSOTBSSVTP-PWNYCUMCSA-N -HMDB0000618 230.01915384 "D-Ribulose 5-phosphate" C5H11O8P FNZLKVNUWIIPSJ-UHNVWZDZSA-N -HMDB0000625 196.058302738 "Gluconic acid" C6H12O7 RGHNJXZEOKUKBD-SQOUGZDYSA-N -HMDB0000638 200.177630012 "Dodecanoic acid" C12H24O2 POULHZVOKOAJMA-UHFFFAOYSA-N -HMDB0000639 210.037567296 "Galactaric acid" C6H10O8 DSLZVSRJTYRBFB-DUHBMQHGSA-N -HMDB0000641 146.069142196 L-Glutamine C5H10N2O3 ZDXPYRJPNDTMRX-VKHMYHEASA-N -HMDB0000650 103.063328537 "D-alpha-Aminobutyric acid" C4H9NO2 QWCKQJZIFLGMSD-GSVOUGTGSA-N -HMDB0000656 426.08790508 "Cysteineglutathione disulfide" C13H22N4O8S2 BNRXZEPOHPEEAS-PPSBICQBSA-N -HMDB0000657 62.929601079 Copper Cu JPVYNHNXODAKFH-UHFFFAOYSA-N -HMDB0000660 180.063388116 D-Fructose C6H12O6 RFSUNEUAIZKAJO-ARQDHWQXSA-N -HMDB0000661 132.042258744 "Glutaric acid" C5H8O4 JFCQEDHGNNZCLN-UHFFFAOYSA-N -HMDB0000662 18.998403205 Fluoride F KRHYYFGTRYWZRS-UHFFFAOYSA-M -HMDB0000666 130.099379692 "Heptanoic acid" C7H14O2 MNWFXJYAOYHMED-UHFFFAOYSA-N -HMDB0000673 280.240230268 "Linoleic acid" C18H32O2 OYHQOLUKZRVURQ-HZJYTTRNSA-N -HMDB0000687 131.094628665 L-Leucine C6H13NO2 ROHFNLRQFUQHCH-YFKPBYRVSA-N -HMDB0000688 245.162708229 Isovalerylcarnitine C12H23NO4 IGQBPDJNUXPEMT-UHFFFAOYSA-N -HMDB0000689 116.083729628 "Isocaproic acid" C6H12O2 FGKJLKRYENPLQH-UHFFFAOYSA-N -HMDB0000691 104.010958616 "Malonic acid" C3H4O4 OFOBLEOULBTSOW-UHFFFAOYSA-N -HMDB0000692 55.934942133 Fe2+ Fe CWYNVVGOOAEACU-UHFFFAOYSA-N -HMDB0000694 148.037173366 "L-2-Hydroxyglutaric acid" C5H8O5 HWXBTNAVRSUOJR-VKHMYHEASA-N -HMDB0000695 130.062994186 Ketoleucine C6H10O3 BKAJNAXTPSGJCU-UHFFFAOYSA-N -HMDB0000696 149.051049291 L-Methionine C5H11NO2S FFEARJCKVFRZRR-BYPYZUCNSA-N -HMDB0000710 104.047344122 "4-Hydroxybutyric acid" C4H8O3 SJZRECIVHVDYJC-UHFFFAOYSA-N -HMDB0000711 160.109944378 "Hydroxyoctanoic acid" C8H16O3 JKRDADVRIYVCCY-UHFFFAOYSA-N -HMDB0000714 179.058243159 "Hippuric acid" C9H9NO3 QIAFMBKCNZACKA-UHFFFAOYSA-N -HMDB0000718 102.068079564 "Isovaleric acid" C5H10O2 GWYFCOCPABKNJV-UHFFFAOYSA-N -HMDB0000720 116.047344122 "Levulinic acid" C5H8O3 JOOXCMJARBKPKM-UHFFFAOYSA-N -HMDB0000721 172.08479226 Glycylproline C7H12N2O3 KZNQNBZMBZJQJO-UHFFFAOYSA-N -HMDB0000725 131.058243159 4-Hydroxyproline C5H9NO3 PMMYEEVYMWASQN-DMTCNVIQSA-N -HMDB0000729 104.047344122 "Alpha-Hydroxyisobutyric acid" C4H8O3 BWLBGMIXKSTLSX-UHFFFAOYSA-N -HMDB0000738 117.057849229 Indole C8H7N SIKJAQJRHWYJAI-UHFFFAOYSA-N -HMDB0000742 135.035399227 Homocysteine C4H9NO2S FFFHZYDWPBMWHY-UHFFFAOYSA-N -HMDB0000744 134.021523302 "Malic acid" C4H6O5 BJEPYKJPYRNKOW-UHFFFAOYSA-N -HMDB0000746 132.07864425 "Hydroxyisocaproic acid" C6H12O3 LVRFTAZAXQPQHI-YFKPBYRVSA-N -HMDB0000748 166.062994186 "L-3-Phenyllactic acid" C9H10O3 VOXXWSYKYCBWHO-MRVPVSSYSA-N -HMDB0000755 182.057908808 "Hydroxyphenyllactic acid" C9H10O4 JVGVDSSUAVXRDY-UHFFFAOYSA-N -HMDB0000759 188.116092388 Glycylleucine C8H16N2O3 DKEXFJVMVGETOO-LURJTMIESA-N -HMDB0000764 150.068079564 "Hydrocinnamic acid" C9H10O2 XMIIGOLPHOKFCH-UHFFFAOYSA-N -HMDB0000765 182.07903818 Mannitol C6H14O6 FBPFZTCFMRRESA-KVTDHHQDSA-N -HMDB0000779 166.062994186 "Phenyllactic acid" C9H10O3 VOXXWSYKYCBWHO-UHFFFAOYSA-N -HMDB0000784 188.104859 "Azelaic acid" C9H16O4 BDJRBEYXGGNYIS-UHFFFAOYSA-N -HMDB0000803 221.089937217 beta-N-Acetylglucosamine C8H15NO6 OVRNDRQMDRJTHS-FMDGEEDCSA-N -HMDB0000805 129.042593095 "Pyrrolidonecarboxylic acid" C5H7NO3 ODHCTXKNWHHXJC-UHFFFAOYSA-N -HMDB0000806 228.20893014 "Myristic acid" C14H28O2 TUNFSRHWOTWDNC-UHFFFAOYSA-N -HMDB0000807 185.99293909 "3-Phosphoglyceric acid" C3H7O7P OSJPPGNTCRNQQC-UHFFFAOYSA-N -HMDB0000812 175.048072403 "N-Acetyl-L-aspartic acid" C6H9NO5 OTCCIMWXFLJLIA-BYPYZUCNSA-N -HMDB0000820 60.057514878 "Propyl alcohol" C3H8O BDERNNFJNOPAEC-UHFFFAOYSA-N -HMDB0000821 193.073893223 Phenylacetylglycine C10H11NO3 UTYVDVLMYQPLQB-UHFFFAOYSA-N -HMDB0000824 217.131408101 Propionylcarnitine C10H19NO4 UFAHZIUFPNSHSL-UHFFFAOYSA-N -HMDB0000826 242.224580204 "Pentadecanoic acid" C15H30O2 WQEPLUUGTLDZJY-UHFFFAOYSA-N -HMDB0000827 284.271530396 "Stearic acid" C18H36O2 QIQXTHQIDYTFRH-UHFFFAOYSA-N -HMDB0000828 176.043321376 "Ureidosuccinic acid" C5H8N2O5 HLKXYZVTANABHZ-REOHCLBHSA-N -HMDB0000847 158.13067982 "Pelargonic acid" C9H18O2 FBUKVWPVBMHYJY-UHFFFAOYSA-N -HMDB0000863 60.057514878 "Isopropyl alcohol" C3H8O KFZMGEQAYNKOFK-UHFFFAOYSA-N -HMDB0000870 111.079647303 Histamine C5H9N3 NTYJJOPFIAHURM-UHFFFAOYSA-N -HMDB0000876 384.33921603 "Vitamin D3" C27H44O QYSXJUFSXHHAJI-YRZJJWOYSA-N -HMDB0000883 117.078978601 L-Valine C5H11NO2 KZSNJWFQEVHDMF-BYPYZUCNSA-N -HMDB0000888 216.136159128 "Undecanedioic acid" C11H20O4 LWBHHRRTOZQPDM-UHFFFAOYSA-N -HMDB0000892 102.068079564 "Valeric acid" C5H10O2 NQPDZGIKBAWPEJ-UHFFFAOYSA-N -HMDB0000895 146.118103761 "Acetylcholine " C7H16NO2 OIPILFWXSMYKGL-UHFFFAOYSA-N -HMDB0000898 125.095297367 1-Methylhistamine C6H11N3 FHQDWPCFSJMNCT-UHFFFAOYSA-N -HMDB0000900 396.33921603 Ergocalciferol C28H44O MECHNRXZTMCUDQ-RKHKHRCZSA-N -HMDB0000904 175.095691297 Citrulline C6H13N3O3 RHGKLRLOHDJJDR-BYPYZUCNSA-N -HMDB0000906 59.073499293 Trimethylamine C3H9N GETQZCLCWQTVFV-UHFFFAOYSA-N -HMDB0000910 214.193280076 "Tridecanoic acid" C13H26O2 SZHOJFHSIKHZHA-UHFFFAOYSA-N -HMDB0000925 75.068413915 "Trimethylamine N-oxide" C3H9NO UYPYRKYUKCHHIB-UHFFFAOYSA-N -HMDB0000929 204.089877638 L-Tryptophan C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N -HMDB0000930 148.0524295 "trans-Cinnamic acid" C9H8O2 WBYWAXJHAXSJNI-VOTSOKGWSA-N -HMDB0000943 136.037173366 "Threonic acid" C4H8O5 JPIJQSOTBSSVTP-GBXIJSLDSA-N -HMDB0000957 110.036779436 Pyrocatechol C6H6O2 YCIMNLLNPGFGHC-UHFFFAOYSA-N -HMDB0000962 205.059505487 Lipoamide C8H15NOS2 FCCDDURTIIUXBY-UHFFFAOYSA-N -HMDB0000965 109.019749163 Hypotaurine C2H7NO2S VVIUBCNYACGLLV-UHFFFAOYSA-N -HMDB0000990 44.02621475 Acetaldehyde C2H4O IKHGUXGNUITLKF-UHFFFAOYSA-N -HMDB0001043 304.240230268 "Arachidonic acid" C20H32O2 YZXBAPSDXZZRGB-DOFZRALJSA-N -HMDB0001046 176.094963016 Cotinine C10H12N2O UIKROCXWUNQSPJ-UHFFFAOYSA-N -HMDB0001062 301.056267627 "N-Acetyl-D-Glucosamine 6-Phosphate" C8H16NO9P BRGMHAYQAZFZDJ-RTRLPJTCSA-N -HMDB0001068 290.040283212 "D-Sedoheptulose 7-phosphate" C7H15O10P CBIDVWSRUUODHL-QTSLKERKSA-N -HMDB0001096 140.982708755 "Carbamoyl phosphate" CH4NO5P FFQKYPRQEYGKAF-UHFFFAOYSA-N -HMDB0001122 59.037113787 N-Methylformamide C2H5NO ATHHXGZTWNVVOU-UHFFFAOYSA-N -HMDB0001138 189.063722467 "N-Acetylglutamic acid" C7H11NO5 RFMMMVDNIPUKGG-UHFFFAOYSA-N -HMDB0001140 128.120115134 Octanal C8H16O NUJGJRNETVAIRJ-UHFFFAOYSA-N -HMDB0001161 146.118103761 "4-Trimethylammoniobutanoic acid" C7H16NO2 JHPNVNIEXXLNTR-UHFFFAOYSA-O -HMDB0001184 84.057514878 "Methyl propenyl ketone" C5H8O LABTWGUMFABVFG-ONEGZZNKSA-N -HMDB0001190 159.068413915 Indoleacetaldehyde C10H9NO WHOOUMGHGSPMGR-UHFFFAOYSA-N -HMDB0001218 146.036779433 Coumarin C9H6O2 ZYGHJZDHTFUPRJ-UHFFFAOYSA-N -HMDB0001247 26.981538441 Aluminum Al XAGFODPZIPBFFR-UHFFFAOYSA-N -HMDB0001256 202.215746852 Spermine C10H26N4 PFNFFQXMRSDOHW-UHFFFAOYSA-N -HMDB0001257 145.157897623 Spermidine C7H19N3 ATHGHQPFGPMSJY-UHFFFAOYSA-N -HMDB0001302 97.905407846 Molybdenum Mo MMVYPOCJESWGTC-UHFFFAOYSA-N -HMDB0001315 30.973761512 Phosphorus P OAICVXFJPJFONN-UHFFFAOYSA-N -HMDB0001316 276.024633148 "6-Phosphogluconic acid" C6H13O10P BIRSGZKFKXLSJQ-SQOUGZDYSA-N -HMDB0001327 84.911789341 Rubidium Rb NCCSSGKUIKYAJD-UHFFFAOYSA-N -HMDB0001333 54.938049636 Manganese Mn WAEMQWOKJMHJLA-UHFFFAOYSA-N -HMDB0001341 427.029414749 ADP C10H15N5O10P2 XTWYTFMLZFPYCI-KQYNXXCUSA-N -HMDB0001348 731.606699942 SM(d18:1/18:0) C41H84N2O6P LKQLRGMMMAHREN-YJFXYUILSA-O -HMDB0001349 79.916521828 Selenium Se MFSBVGSNNPNWMD-UHFFFAOYSA-N -HMDB0001366 120.043596148 Purine C5H4N4 KDCGOANMDULRCW-UHFFFAOYSA-N -HMDB0001367 301.056267627 "N-Acetyl-glucosamine 1-phosphate" C8H16NO9P FZLJPEPAYPUMMR-RTRLPJTCSA-N -HMDB0001369 129.042593095 "Pyrroline hydroxycarboxylic acid" C5H7NO3 WFOFKRKDDKGRIK-UHFFFAOYSA-N -HMDB0001388 278.224580204 "Alpha-Linolenic acid" C18H30O2 DTOSIQBPPRVQHS-PDBXOOCHSA-N -HMDB0001389 232.121177766 Melatonin C13H16N2O2 DRLFMBDRBRZALE-UHFFFAOYSA-N -HMDB0001390 192.089877638 Hydroxycotinine C10H12N2O2 XOKCJXZZNAUIQN-IENPIDJESA-N -HMDB0001397 363.057998961 "Guanosine monophosphate" C10H14N5O8P RQFCJASXJCIDSX-UUOKFMHZSA-N -HMDB0001401 260.029718526 "Glucose 6-phosphate" C6H13O9P NBSCHQHZLSJFNQ-GASJEMHNSA-N -HMDB0001414 88.100048394 Putrescine C4H12N2 KIDHWZJUCRJVML-UHFFFAOYSA-N -HMDB0001429 97.976895096 Phosphate H3O4P NBIIXXVUZAFLBC-UHFFFAOYSA-N -HMDB0001432 130.121846468 Agmatine C5H14N4 QYPPJABKJHAVHS-UHFFFAOYSA-N -HMDB0001448 97.967379242 Sulfate H2O4S QAOWNCQODCNURD-UHFFFAOYSA-N -HMDB0001453 57.975144695 Thiocyanate CNS ZMZDMBWJUHKJPS-UHFFFAOYSA-M -HMDB0001473 169.998024468 "Dihydroxyacetone phosphate" C3H7O6P GNGACRATGGDKBX-UHFFFAOYSA-N -HMDB0001475 89.904703679 Zirconium Zr GBNDTYKAOXLLID-UHFFFAOYSA-N -HMDB0001478 71.949056008 Gallium GaH3 PHMDYZQXPPOZDG-UHFFFAOYSA-N -HMDB0001485 114.140850576 Octane C8H18 TVMXDCGIABBOFY-UHFFFAOYSA-N -HMDB0001488 123.032028409 "Nicotinic acid" C6H5NO2 PVNIIMVLHYAWGP-UHFFFAOYSA-N -HMDB0001505 78.046950192 Benzene C6H6 UHOVQNZJYSORNB-UHFFFAOYSA-N -HMDB0001514 179.079372531 Glucosamine C6H13NO5 MSWZFWKMSRAUBD-IVMDWMLBSA-N -HMDB0001517 338.062749988 AICAR C9H15N4O8P NOTGFIUVDGNKRI-UUOKFMHZSA-N -HMDB0001522 73.063997239 Methylguanidine C2H7N3 CHJJGSNFBQVOTG-UHFFFAOYSA-N -HMDB0001548 230.01915384 "D-Ribose 5-phosphate" C5H11O8P KTVPXOYAKDPRHY-SOOFDHNKSA-N -HMDB0001565 184.073869485 Phosphorylcholine C5H15NO4P YHHSONZFOIEMCP-UHFFFAOYSA-O -HMDB0001586 260.029718526 "Glucose 1-phosphate" C6H13O9P HXXFSFRBOHSIMQ-GASJEMHNSA-N -HMDB0001659 58.041864814 Acetone C3H6O CSCPPACGZOOCGX-UHFFFAOYSA-N -HMDB0001844 132.042258744 "Methylsuccinic acid" C5H8O4 WXUAQHNMJWJLTG-UHFFFAOYSA-N -HMDB0001847 194.080375584 Caffeine C8H10N4O2 RYYVLZVUVIJVGH-UHFFFAOYSA-N -HMDB0001851 152.068473494 L-Arabitol C5H12O5 HEBKCHPVOIAQTA-IMJSIDKUSA-N -HMDB0001854 129.906222753 Tellurium Te LHBANKJAFPUZQV-UHFFFAOYSA-N -HMDB0001858 108.057514878 p-Cresol C7H8O IWDCLRJOBJJRNH-UHFFFAOYSA-N -HMDB0001859 151.063328537 Acetaminophen C8H9NO2 RZVAJINKPMORJF-UHFFFAOYSA-N -HMDB0001860 180.06472552 Paraxanthine C7H8N4O2 QUNWUDVFRNGTCO-UHFFFAOYSA-N -HMDB0001864 130.062994186 "2-Ketohexanoic acid" C6H10O3 XNIHZNNZJHYHLC-UHFFFAOYSA-N -HMDB0001870 122.036779433 "Benzoic acid" C7H6O2 WPYMKLBDIGXBTP-UHFFFAOYSA-N -HMDB0001873 88.0524295 "Isobutyric acid" C4H8O2 KQNPFQTWMSNSAP-UHFFFAOYSA-N -HMDB0001875 32.02621475 Methanol CH4O OKKJLVBELUTLKV-UHFFFAOYSA-N -HMDB0001878 150.104465071 Thymol C10H14O MGSRCZKZVOBKFT-UHFFFAOYSA-N -HMDB0001881 76.0524295 "Propylene glycol" C3H8O2 DNIAPMSPPWPWGF-UHFFFAOYSA-N -HMDB0001888 73.052763851 N,N-Dimethylformamide C3H7NO ZMXDDKWLCZADIW-UHFFFAOYSA-N -HMDB0001893 430.381080844 alpha-Tocopherol C29H50O2 GVJHHUAWPYXKBD-IEOSBIPESA-N -HMDB0001894 294.121571696 Aspartame C14H18N2O5 IAOZJIPTCAWIRG-QWRGUYRKSA-N -HMDB0001895 138.031694053 "Salicylic acid" C7H6O3 YGSDEFSMJLZEOE-UHFFFAOYSA-N -HMDB0001934 162.115698458 Nicotine C10H14N2 SNICXCGAKADSCV-JTQLQIEISA-N -HMDB0001960 123.933496699 Tin H4Sn PXQLTWWGPFDWNT-UHFFFAOYSA-N -HMDB0001966 47.947947053 Titanium Ti LCKIEQZJEYYRIY-UHFFFAOYSA-N -HMDB0001989 183.950932553 Tungsten W YFGRPIXHCIXTLM-UHFFFAOYSA-N -HMDB0002000 226.193280076 "Myristoleic acid" C14H26O2 YWWVWXASSLXJHU-WAYWQWQTSA-N -HMDB0002005 165.045963913 "Methionine sulfoxide" C5H11NO3S QEFRNWWLZKMPFJ-UHFFFAOYSA-N -HMDB0002013 231.14705816 Butyrylcarnitine C11H21NO4 QWYFHHGCZUCMBN-SECBINFHSA-N -HMDB0002030 179.079372531 Fructosamine C6H13NO5 IXZISFNWUWKBOM-ARQDHWQXSA-N -HMDB0002048 108.057514878 m-Cresol C7H8O RLSSMJSEOOYNOY-UHFFFAOYSA-N -HMDB0002056 222.089208936 "Monoisobutyl phthalic acid" C12H14O4 RZJSUWQGFCHNFS-UHFFFAOYSA-N -HMDB0002064 130.11061308 N-Acetylputrescine C6H14N2O KLZGKIDSEJWEDW-UHFFFAOYSA-N -HMDB0002072 166.062994186 "4-Methoxyphenylacetic acid" C9H10O3 NRPFNQUDKRYCNX-UHFFFAOYSA-N -HMDB0002085 198.052823422 "Syringic acid" C9H10O5 JMSVCTWVEWCHDZ-UHFFFAOYSA-N -HMDB0002107 166.02660868 "Phthalic acid" C8H6O4 XNGIFLGASWRNHJ-UHFFFAOYSA-N -HMDB0002111 18.010564686 Water H2O XLYOFNOQVPJJNP-UHFFFAOYSA-N -HMDB0002120 194.057908808 "Monoethyl phthalate" C10H10O4 YWWHKOHZGJFMIE-UHFFFAOYSA-N -HMDB0002130 180.042258744 "Monomethyl phthalate" C9H8O4 FNJSWIPFHMKRAT-UHFFFAOYSA-N -HMDB0002176 102.068079564 "Ethylmethylacetic acid" C5H10O2 WLAMNBDJUVNPJU-UHFFFAOYSA-N -HMDB0002189 187.168462309 N8-Acetylspermidine C9H21N3O FONIWJIDLJEJTL-UHFFFAOYSA-N -HMDB0002199 166.062994186 Desaminotyrosine C9H10O3 NMHMNPHRMNGLLB-UHFFFAOYSA-N -HMDB0002231 310.28718046 "11Z-Eicosenoic acid" C20H38O2 BITHHVVYSMSWAG-KTKRTIGZSA-N -HMDB0002243 123.032028409 "Picolinic acid" C6H5NO2 SIOXPEMLGUPBBT-UHFFFAOYSA-N -HMDB0002259 270.255880332 "Heptadecanoic acid" C17H34O2 KEMQGTRYUADPNZ-UHFFFAOYSA-N -HMDB0002290 74.921596417 Arsenic As LULLIKNODDLMDQ-UHFFFAOYSA-N -HMDB0002302 189.078978601 "Indole-3-propionic acid" C11H11NO2 GOLXRNDWAUTYKT-UHFFFAOYSA-N -HMDB0002322 102.115698458 Cadaverine C5H14N2 VHRGRCVQAFMJIZ-UHFFFAOYSA-N -HMDB0002329 89.995308552 "Oxalic acid" C2H2O4 MUBZPKHOEPUJKR-UHFFFAOYSA-N -HMDB0002340 136.0524295 "2-Methylbenzoic acid" C8H8O2 ZWLPBLYKEWSWPD-UHFFFAOYSA-N -HMDB0002350 270.292265838 Octadecanol C18H38O GLDOVTGHNKAZLK-UHFFFAOYSA-N -HMDB0002386 11.009305466 Boron B FRWDHMWMHYXNLW-UHFFFAOYSA-N -HMDB0002428 166.02660868 "Terephthalic acid" C8H6O4 KKEYFWRCBNTPAC-UHFFFAOYSA-N -HMDB0002457 57.935347922 Nickel Ni VEQPNABPJHWNSG-UHFFFAOYSA-N -HMDB0002501 73.921178213 Germanium Ge CULSIAXQVSZNSV-UHFFFAOYSA-N -HMDB0002503 50.943963675 Vanadium V KOKKJWHERHSKEB-UHFFFAOYSA-N -HMDB0002712 164.068473494 1,5-Anhydrosorbitol C6H12O5 MPCAJMNYNOGXPB-SLPGGIOYSA-N -HMDB0002786 47.000728281 Nitrite HNO2 IOVCWXUNBOPUCH-UHFFFAOYSA-N -HMDB0002820 140.05857751 "Methylimidazoleacetic acid" C6H8N2O2 ZHCKPJGJQOPTLB-UHFFFAOYSA-N -HMDB0002825 180.06472552 Theobromine C7H8N4O2 YAPQBXQYLJRXSA-UHFFFAOYSA-N -HMDB0002917 152.068473494 D-Xylitol C5H12O5 HEBKCHPVOIAQTA-NGQZWQHPSA-N -HMDB0002923 342.116211546 Isomaltose C12H22O11 DLRVVLDZNNYCBX-RTPHMHGBSA-N -HMDB0002931 147.053157781 N-Acetylserine C5H9NO4 JJIHLJJYMXLCOY-BYPYZUCNSA-N -HMDB0002939 100.088815006 "Methyl isobutyl ketone" C6H12O NTIZESTWPVYFNL-UHFFFAOYSA-N -HMDB0002994 122.057908808 Erythritol C4H10O4 UNXHWFMMPAWVPI-ZXZARUISSA-N -HMDB0003072 192.063388116 "Quinic acid" C7H12O6 AAWZDTNXLSGCEK-RKGSPJAZSA-N -HMDB0003119 108.057514878 "Benzyl alcohol" C7H8O WVDDGKGOMKODPV-UHFFFAOYSA-N -HMDB0003178 616.177297665 Heme C34H32FeN4O4 KABFMIBPWCXCRK-RGGAHWMASA-L -HMDB0003229 254.224580204 "Palmitoleic acid" C16H30O2 SECPZKHBENQXJG-FPLPWBNLSA-N -HMDB0003231 282.255880335 "Vaccenic acid" C18H34O2 UWHZIFQPPBDJPM-BQYQJAHWSA-N -HMDB0003243 88.0524295 Acetoin C4H8O2 ROWKJAVDOGWPAT-UHFFFAOYSA-N -HMDB0003334 202.14297584 "Symmetric dimethylarginine" C8H18N4O2 HVPFXCBJHIIJGS-LURJTMIESA-N -HMDB0003337 612.151961898 "Oxidized glutathione" C20H32N6O12S2 YPZRWBKMTBYPTK-UHFFFAOYSA-N -HMDB0003339 147.053157781 "D-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-GSVOUGTGSA-N -HMDB0003345 180.063388116 Alpha-D-Glucose C6H12O6 WQZGKKKJIJFFOK-DVKNGEFBSA-N -HMDB0003352 156.151415264 Menthol C10H20O NOOLISFMXDJSKH-KXUCPTDWSA-N -HMDB0003355 117.078978601 "5-Aminopentanoic acid" C5H11NO2 JJMDCOVWQOJGCB-UHFFFAOYSA-N -HMDB0003357 174.100442324 N-Acetylornithine C7H14N2O3 JRLGPAXAGHMNOL-LURJTMIESA-N -HMDB0003361 80.037448138 Pyrimidine C4H4N2 CZPWVGJYEJSRLH-UHFFFAOYSA-N -HMDB0003366 58.041864814 Propanal C3H6O NBBJYMSMWIIQGU-UHFFFAOYSA-N -HMDB0003374 132.089877638 D-Ornithine C5H12N2O2 AHLPHDHHMVZTML-SCSAIBSYSA-N -HMDB0003406 105.042593095 D-Serine C3H7NO3 MTCFGRXMJLQNBG-UWTATZPHSA-N -HMDB0003407 86.036779436 Diacetyl C4H6O2 QSJXEFYPDANLFS-UHFFFAOYSA-N -HMDB0003417 121.019749643 D-Cysteine C3H7NO2S XUJNEKJLAYXESH-UWTATZPHSA-N -HMDB0003418 180.063388116 D-Tagatose C6H12O6 BJHIKXHVCXFQLS-PQLUHFTBSA-N -HMDB0003423 146.069142196 D-Glutamine C5H10N2O3 ZDXPYRJPNDTMRX-GSVOUGTGSA-N -HMDB0003459 160.08479226 D-Alanyl-D-alanine C6H12N2O3 DEFJQIDDEAULHB-QWWZWVQMSA-N -HMDB0003466 178.047738052 L-Gulonolactone C6H10O6 SXZYCXMUPBBULW-SKNVOMKLSA-N -HMDB0003538 62.00039393 "Carbonic acid" CH2O3 BVKZGUZCCUSVTD-UHFFFAOYSA-N -HMDB0003540 347.063084339 3'-AMP C10H14N5O7P LNQVTSROQXJCDD-KQYNXXCUSA-N -HMDB0003638 113.903358121 Cadmium Cd WLZRMCYVCSSEQC-UHFFFAOYSA-N -HMDB0003642 87.905614339 Strontium Sr PWYYWQHXAPXYMF-UHFFFAOYSA-N -HMDB0003647 150.104465071 "Perillyl aldehyde" C10H14O RUMOYJJNUMEFDD-UHFFFAOYSA-N -HMDB0003671 114.10446507 2-Heptanone C7H14O CATSNJVOTSVZJV-UHFFFAOYSA-N -HMDB0004096 205.073893223 5-Methoxyindoleacetate C11H11NO3 COCNDHOPIHDTHK-UHFFFAOYSA-N -HMDB0004142 137.905241273 Barium Ba XDFCIPNJCBUZJN-UHFFFAOYSA-N -HMDB0004231 205.131408101 Pantothenol C9H19NO4 SNPLKNRPJHDVJA-UHFFFAOYSA-N -HMDB0004321 136.125200512 (+)-Limonene C10H16 XMGQYMWWDOXHJM-JTQLQIEISA-N -HMDB0004327 74.073164942 1-Butanol C4H10O LRHPLDYGYMQRHN-UHFFFAOYSA-N -HMDB0004461 121.052763851 Benzamide C7H7NO KXDAEFPNCMNJSK-UHFFFAOYSA-N -HMDB0004472 154.1357652 Eucalyptol C10H18O WEEGYLXZBRQIMU-UHFFFAOYSA-N -HMDB0004628 207.97663585 Lead Pb RVPVRDXYQKGNMQ-UHFFFAOYSA-N -HMDB0004814 114.10446507 4-Heptanone C7H14O HCFAJYNVAYBARA-UHFFFAOYSA-N -HMDB0004827 143.094628665 "Proline betaine" C7H13NO2 CMUNUTVVOOHQPW-LURJTMIESA-N -HMDB0004983 94.008850126 "Dimethyl sulfone" C2H6O2S HHVIBTZHLRERCL-UHFFFAOYSA-N -HMDB0005066 371.303558805 Tetradecanoylcarnitine C21H41NO4 PSHXNVGSVNEJBD-LJQANCHMSA-N -HMDB0005802 164.083729628 Isoeugenol C10H12O2 BJIOGJUNALELMI-ONEGZZNKSA-N -HMDB0005805 134.109550451 p-Cymene C10H14 HFPZCAJZSCWRBC-UHFFFAOYSA-N -HMDB0005806 136.125200515 Gamma-terpinene C10H16 YKFLAYDHMOASIY-UHFFFAOYSA-N -HMDB0005809 164.083729628 Eugenol C10H12O2 RRAFCDWBNXTKKO-UHFFFAOYSA-N -HMDB0005812 154.1357652 Geraniol C10H18O GLZPCOQZEFWAFX-YFHOEESVSA-N -HMDB0005843 99.014269855 "Allyl isothiocyanate" C4H5NS ZOJBYZNEUISWFT-UHFFFAOYSA-N -HMDB0005879 93.991091572 Dimethyldisulfide C2H6S2 WQOXQRCZOLPYPM-UHFFFAOYSA-N -HMDB0005949 7.016004049 Lithium Li HBBGRARXTFLTSG-UHFFFAOYSA-N -HMDB0005994 100.088815006 Hexanal C6H12O JARKCYVAAOWBJS-UHFFFAOYSA-N -HMDB0006006 74.073164942 Isobutanol C4H10O ZXEKIIBDNHEJCQ-UHFFFAOYSA-N -HMDB0006007 88.088815006 Isopentanol C5H12O PHTQWCKDNZKARW-UHFFFAOYSA-N -HMDB0006088 180.063388116 scyllo-Inositol C6H12O6 CDAISMWEOUEBRE-CDRYSYESSA-N -HMDB0006111 320.23514489 12-HETE C20H32O3 ZNHVWPKMFKADKW-FYMOKONMSA-N -HMDB0006115 106.041864814 Benzaldehyde C7H6O HUMNYLRZRPPJDN-UHFFFAOYSA-N -HMDB0006213 76.0524295 (S)-Propane-1,2-diol C3H8O2 DNIAPMSPPWPWGF-VKHMYHEASA-N -HMDB0006272 131.058243159 "5-Amino-2-oxopentanoic acid" C5H9NO3 BWHGMFYTDQEALD-UHFFFAOYSA-N -HMDB0006478 86.073164942 Iso-Valeraldehyde C5H10O YGHRJJRRZDOVPD-UHFFFAOYSA-N -HMDB0007871 733.562155053 PC(14:0/18:0) C40H80NO8P TYAQXZHDAGZOEO-KXQOOQHDSA-N -HMDB0007879 759.577805117 PC(14:0/20:1(11Z)) C42H82NO8P DMEBDXIQFIKNQR-OIJJMQLXSA-N -HMDB0007880 757.562155053 PC(14:0/20:2(11Z,14Z)) C42H80NO8P IRYMXEVDAKMFIF-YBLKGUNISA-N -HMDB0007881 755.546504989 PC(14:0/20:3(5Z,8Z,11Z)) C42H78NO8P XWHIBISICRMDDW-ZLBNXBDKSA-N -HMDB0007882 755.546504989 PC(14:0/20:3(8Z,11Z,14Z)) C42H78NO8P ZAUFLMLTXNKVAB-AFYHZPHLSA-N -HMDB0007887 787.609105245 PC(14:0/22:1(13Z)) C44H86NO8P LOVKBDFNFACEND-HSEDGGQWSA-N -HMDB0007888 785.593455181 PC(14:0/22:2(13Z,16Z)) C44H84NO8P BRAPXNOAYHMWEX-JHHJWKSXSA-N -HMDB0007889 781.562155053 PC(14:0/22:4(7Z,10Z,13Z,16Z)) C44H80NO8P UDOCLKXJVMJFLD-CCHOKCMJSA-N -HMDB0007890 779.546504989 PC(14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C44H78NO8P MGUTYWPZCZBAGE-JZDIRDTQSA-N -HMDB0007891 779.546504989 PC(14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C44H78NO8P SFEMWZZGMMRGCX-DYPKKMQZSA-N -HMDB0007896 717.567240431 PC(14:0/P-18:0) C40H80NO7P RGTWJEUZOMLQFH-JCUPVDEDSA-N -HMDB0007911 759.577805117 PC(14:1(9Z)/20:0) C42H82NO8P SJLGFZBXPQKJIH-LLVYEJTBSA-N -HMDB0007912 757.562155053 PC(14:1(9Z)/20:1(11Z)) C42H80NO8P OLUKQTJCNPHKRC-LYJZGNKWSA-N -HMDB0007913 755.546504989 PC(14:1(9Z)/20:2(11Z,14Z)) C42H78NO8P KBHCBANQRIOXLD-FRPVHTQQSA-N -HMDB0007919 787.609105245 PC(14:1(9Z)/22:0) C44H86NO8P OSTGKIDWKPXCRQ-FASREOMLSA-N -HMDB0007920 785.593455181 PC(14:1(9Z)/22:1(13Z)) C44H84NO8P CGXBWJDAGMQUFG-MHJIJCEHSA-N -HMDB0007921 783.577805117 PC(14:1(9Z)/22:2(13Z,16Z)) C44H82NO8P LMYYUVAVNWPEPG-GXAHKNHCSA-N -HMDB0007922 779.546504989 PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C44H78NO8P XBLSNYPBWMKQLW-WPNBCRARSA-N -HMDB0007971 759.577805117 PC(16:0/18:1(11Z)) C42H82NO8P AEPVLLKGEBHLEJ-KWNHIAGJSA-N -HMDB0007972 759.577805117 PC(16:0/18:1(9Z)) C42H82NO8P WTJKGGKOPKCXLL-VYOBOKEXSA-N -HMDB0007973 757.562155053 PC(16:0/18:2(9Z,12Z)) C42H80NO8P JLPULHDHAOZNQI-ZTIMHPMXSA-N -HMDB0007974 755.546504989 PC(16:0/18:3(6Z,9Z,12Z)) C42H78NO8P CNNSEHUKQJCGTE-UPPWDXJYSA-N -HMDB0007975 755.546504989 PC(16:0/18:3(9Z,12Z,15Z)) C42H78NO8P JMAYDGBZRHQJAT-QWFQJEORSA-N -HMDB0007978 787.609105245 PC(16:0/20:1(11Z)) C44H86NO8P MZZHKIPFYPOYKP-NYJULOOZSA-N -HMDB0007979 785.593455181 PC(16:0/20:2(11Z,14Z)) C44H84NO8P ZRTZULWIAWDUBY-UXSLIEDSSA-N -HMDB0007980 783.577805117 PC(16:0/20:3(5Z,8Z,11Z)) C44H82NO8P XMZFUVYOYPLVOA-VLHUWQDUSA-N -HMDB0007981 783.577805117 PC(16:0/20:3(8Z,11Z,14Z)) C44H82NO8P SRIGHEHXEGELQJ-YYQUKWHJSA-N -HMDB0007982 781.562155053 PC(16:0/20:4(5Z,8Z,11Z,14Z)) C44H80NO8P IIZPXYDJLKNOIY-JXPKJXOSSA-N -HMDB0007983 781.562155053 PC(16:0/20:4(8Z,11Z,14Z,17Z)) C44H80NO8P JAVWFBAAZSHHAD-HCYAGMRRSA-N -HMDB0007984 779.546504989 PC(16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C44H78NO8P KLTHQSWIRFFBRI-CPFPVJFHSA-N -HMDB0007988 809.593455181 PC(16:0/22:4(7Z,10Z,13Z,16Z)) C46H84NO8P IRWRFKUTKSUFST-MDYGELLQSA-N -HMDB0007989 807.577805117 PC(16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C46H82NO8P MWXAIAMSOXOQJK-JIXVGTEKSA-N -HMDB0007990 807.577805117 PC(16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C46H82NO8P ARDJUHDXABDVFH-ZHSIBHBUSA-N -HMDB0007991 805.562155053 PC(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H80NO8P IESVDEZGAHUQJU-ZLBXKVHBSA-N -HMDB0007994 717.567240431 PC(16:0/P-16:0) C40H80NO7P KEVGQWGZKKFGDC-JCUPVDEDSA-N -HMDB0007996 743.582890495 PC(16:0/P-18:1(11Z)) C42H82NO7P MPQGNHKVOVYEEN-RTVLTNFHSA-N -HMDB0007997 743.582890495 PC(16:0/P-18:1(9Z)) C42H82NO7P UQCSRPHVLJIYTA-ADJITVTDSA-N -HMDB0008003 759.577805117 PC(16:1(9Z)/18:0) C42H82NO8P LJUDFFWSOQEQKW-QCFYSATCSA-N -HMDB0008004 757.562155053 PC(16:1(9Z)/18:1(11Z)) C42H80NO8P JUVGBPLHSDPAMK-JSLHZOBYSA-N -HMDB0008005 757.562155053 PC(16:1(9Z)/18:1(9Z)) C42H80NO8P ZRCWDIULNHKQRD-RWGOWQMXSA-N -HMDB0008006 755.546504989 PC(16:1(9Z)/18:2(9Z,12Z)) C42H78NO8P QJWDAOSZZYVBJZ-KXESGEQTSA-N 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PC(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C46H80NO8P WNHOGFDQJFYPDE-GBGUCBAQSA-N -HMDB0008028 743.582890495 PC(16:1(9Z)/P-18:0) C42H82NO7P IHJLXDUOYHJZQE-IOGJYWBCSA-N -HMDB0008029 741.567240431 PC(16:1(9Z)/P-18:1(11Z)) C42H80NO7P ZFACUKICYTXONE-IWDZABBFSA-N -HMDB0008030 741.567240431 PC(16:1(9Z)/P-18:1(9Z)) C42H80NO7P UMCQOQMEDBTSBS-YJTQHARMSA-N -HMDB0008031 733.562155053 PC(18:0/14:0) C40H80NO8P MZWGYEJOZNRLQE-KXQOOQHDSA-N -HMDB0008035 759.577805117 PC(18:0/16:1(9Z)) C42H82NO8P QRSPNOMDLRZDPG-QCFYSATCSA-N -HMDB0008037 787.609105245 PC(18:0/18:1(11Z)) C44H86NO8P AEAMHDRXCYEOCU-HTDYWKJCSA-N -HMDB0008038 787.609105245 PC(18:0/18:1(9Z)) C44H86NO8P ATHVAWFAEPLPPQ-VRDBWYNSSA-N -HMDB0008039 785.593455181 PC(18:0/18:2(9Z,12Z)) C44H84NO8P FORFDCPQKJHEBF-VPUSDGANSA-N -HMDB0008040 783.577805117 PC(18:0/18:3(6Z,9Z,12Z)) C44H82NO8P KJVJKBRMUDGTKA-NZXQIXPOSA-N -HMDB0008041 783.577805117 PC(18:0/18:3(9Z,12Z,15Z)) C44H82NO8P WZCLAXMADUBPSG-RIXBAXMTSA-N -HMDB0008042 781.562155053 PC(18:0/18:4(6Z,9Z,12Z,15Z)) C44H80NO8P MGIFJPVLDQAGPZ-ROBDCESFSA-N -HMDB0008046 811.609105245 PC(18:0/20:3(5Z,8Z,11Z)) C46H86NO8P QXDDDGCNWRUEFM-UMKMFDOBSA-N -HMDB0008047 811.609105245 PC(18:0/20:3(8Z,11Z,14Z)) C46H86NO8P VGSUMLIRUGDCTF-NSMRCOLJSA-N -HMDB0008048 809.593455181 PC(18:0/20:4(5Z,8Z,11Z,14Z)) C46H84NO8P PSVRFUPOQYJOOZ-QNPWAGBNSA-N -HMDB0008049 809.593455181 PC(18:0/20:4(8Z,11Z,14Z,17Z)) C46H84NO8P HAKKEJDMTIQLJH-UGKDIXSWSA-N -HMDB0008050 807.577805117 PC(18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C46H82NO8P ZMNDHWFRGYCJKG-UQIQIHEKSA-N -HMDB0008059 871.703005629 PC(18:0/24:1(15Z)) C50H98NO8P PAHPUCKPYBHMBM-RURDTVAGSA-N -HMDB0008062 771.614190623 PC(18:0/P-18:1(11Z)) C44H86NO7P JREOXIRIVLLXMO-MWNCGOSWSA-N -HMDB0008063 771.614190623 PC(18:0/P-18:1(9Z)) C44H86NO7P WKBKYWULQUMFDH-DJRFHFPXSA-N -HMDB0008067 759.577805117 PC(18:1(11Z)/16:0) C42H82NO8P WPAONTMCEBPEAF-KWNHIAGJSA-N -HMDB0008068 757.562155053 PC(18:1(11Z)/16:1(9Z)) C42H80NO8P FDBAKEKHEMZAPT-JSLHZOBYSA-N -HMDB0008069 787.609105245 PC(18:1(11Z)/18:0) C44H86NO8P VSQJLPDEJFLZDH-ASXRIEHBSA-N -HMDB0008070 785.593455181 PC(18:1(11Z)/18:1(11Z)) C44H84NO8P XUCDYRWWRZBNCQ-BHOZFUPKSA-N -HMDB0008071 785.593455181 PC(18:1(11Z)/18:1(9Z)) C44H84NO8P FOECFSINPHCSNE-IYXNDCFRSA-N -HMDB0008072 783.577805117 PC(18:1(11Z)/18:2(9Z,12Z)) C44H82NO8P YBNAKFLXDDROCX-YGRWKTHCSA-N -HMDB0008073 781.562155053 PC(18:1(11Z)/18:3(6Z,9Z,12Z)) C44H80NO8P MRRFMOUCAPXWJC-SSCJOAGESA-N -HMDB0008074 781.562155053 PC(18:1(11Z)/18:3(9Z,12Z,15Z)) C44H80NO8P DPEYXLDDNACOGV-ANVMUZGGSA-N -HMDB0008075 779.546504989 PC(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C44H78NO8P QAMLWHXIPWZMCT-WXVJBZSZSA-N -HMDB0008078 811.609105245 PC(18:1(11Z)/20:2(11Z,14Z)) C46H86NO8P MLMXSUWPTPCRLG-HYYWERRFSA-N -HMDB0008079 809.593455181 PC(18:1(11Z)/20:3(5Z,8Z,11Z)) C46H84NO8P GUKWLDDRYZDHHJ-QQZUSIKJSA-N -HMDB0008080 809.593455181 PC(18:1(11Z)/20:3(8Z,11Z,14Z)) C46H84NO8P ILTMNYOFBVFSJD-NIUYMHGESA-N -HMDB0008081 807.577805117 PC(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C46H82NO8P BHFJAGXKWFRMSK-ZUSAGPHLSA-N -HMDB0008082 807.577805117 PC(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C46H82NO8P JZIYIXOCSAGFBB-OYQODMOWSA-N -HMDB0008083 805.562155053 PC(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C46H80NO8P BLXFIBZJVTVAKI-BLPZMAMRSA-N -HMDB0008091 871.703005629 PC(18:1(11Z)/24:0) C50H98NO8P FPXADVQYVJYLOJ-IOVWWOAPSA-N -HMDB0008092 869.687355565 PC(18:1(11Z)/24:1(15Z)) C50H96NO8P PRNSLAVQZUIWHD-PRTODFFFSA-N -HMDB0008093 743.582890495 PC(18:1(11Z)/P-16:0) C42H82NO7P QZDZCTPKRWPFFS-RTVLTNFHSA-N -HMDB0008094 771.614190623 PC(18:1(11Z)/P-18:0) C44H86NO7P FDNRZRXSENYWER-JTLDGTJHSA-N -HMDB0008095 769.598540559 PC(18:1(11Z)/P-18:1(11Z)) C44H84NO7P STUDWKIRLPDNHV-RIWLRQSZSA-N -HMDB0008096 769.598540559 PC(18:1(11Z)/P-18:1(9Z)) C44H84NO7P JAVZDEIBGKQDCN-VRKRHMBPSA-N -HMDB0008100 759.577805117 PC(18:1(9Z)/16:0) C42H82NO8P RRVPPYNAZJRZFR-VYOBOKEXSA-N -HMDB0008101 757.562155053 PC(18:1(9Z)/16:1(9Z)) C42H80NO8P QJZAWHQVXYMEQR-RWGOWQMXSA-N -HMDB0008102 787.609105245 PC(18:1(9Z)/18:0) C44H86NO8P NMJCSTNQFYPVOR-VHONOUADSA-N -HMDB0008103 785.593455181 PC(18:1(9Z)/18:1(11Z)) C44H84NO8P GMCZAOACLPIWHN-VZDDXLEPSA-N -HMDB0008105 783.577805117 PC(18:1(9Z)/18:2(9Z,12Z)) C44H82NO8P GDWULUGDXGHJIJ-VJHNMZKJSA-N -HMDB0008106 781.562155053 PC(18:1(9Z)/18:3(6Z,9Z,12Z)) C44H80NO8P KATPUHPZOZWFBR-ZBFGQIGBSA-N -HMDB0008107 781.562155053 PC(18:1(9Z)/18:3(9Z,12Z,15Z)) C44H80NO8P FVQGNFUBHWGFCY-HJOYQDMMSA-N -HMDB0008108 779.546504989 PC(18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C44H78NO8P VTBLOCMXAXXMCO-ITFWVWPTSA-N -HMDB0008111 811.609105245 PC(18:1(9Z)/20:2(11Z,14Z)) C46H86NO8P MGYXVNKVMWUCEN-UETRTARBSA-N -HMDB0008112 809.593455181 PC(18:1(9Z)/20:3(5Z,8Z,11Z)) C46H84NO8P APIPSPZJMLSCBO-NRTPYZNRSA-N -HMDB0008113 809.593455181 PC(18:1(9Z)/20:3(8Z,11Z,14Z)) C46H84NO8P HLJHXSCXSDXLNW-OHDHZNPQSA-N -HMDB0008114 807.577805117 PC(18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C46H82NO8P ZAYXPDDGEIJGGW-VSDNDEBUSA-N -HMDB0008115 807.577805117 PC(18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C46H82NO8P SWOKEJBWARJLGN-ORKYUJCWSA-N -HMDB0008116 805.562155053 PC(18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C46H80NO8P PAQLDAUPMINLDS-UTNJSSBTSA-N -HMDB0008124 871.703005629 PC(18:1(9Z)/24:0) C50H98NO8P FOWWMXZTRWYEGK-FQUFUIAJSA-N -HMDB0008125 869.687355565 PC(18:1(9Z)/24:1(15Z)) C50H96NO8P VTFFKKZKTDVMKI-JXSZFMCPSA-N -HMDB0008126 743.582890495 PC(18:1(9Z)/P-16:0) C42H82NO7P FQVFGIZCMMQDNV-NQQLFREJSA-N -HMDB0008127 771.614190623 PC(18:1(9Z)/P-18:0) C44H86NO7P HTJGKEVKFGCWNR-DVBGXPIKSA-N -HMDB0008128 769.598540559 PC(18:1(9Z)/P-18:1(11Z)) C44H84NO7P AXIKTMZHHMNCSC-XDEIMXHKSA-N -HMDB0008129 769.598540559 PC(18:1(9Z)/P-18:1(9Z)) C44H84NO7P BNLANPMAYYCMLY-LCXZALMSSA-N -HMDB0008133 757.562155053 PC(18:2(9Z,12Z)/16:0) C42H80NO8P FWMYJLDHIVCJCT-ZTIMHPMXSA-N -HMDB0008134 755.546504989 PC(18:2(9Z,12Z)/16:1(9Z)) C42H78NO8P PPCVNZFMCABQCL-KXESGEQTSA-N -HMDB0008135 785.593455181 PC(18:2(9Z,12Z)/18:0) C44H84NO8P DZPKSVTWWIZUMS-FPUNCOTOSA-N -HMDB0008136 783.577805117 PC(18:2(9Z,12Z)/18:1(11Z)) C44H82NO8P YPAZQMWFRMHBBM-CLKMJQEKSA-N -HMDB0008137 783.577805117 PC(18:2(9Z,12Z)/18:1(9Z)) C44H82NO8P RTAZWRZKFSTMOY-NMSVECGZSA-N -HMDB0008138 781.562155053 PC(18:2(9Z,12Z)/18:2(9Z,12Z)) C44H80NO8P FVXDQWZBHIXIEJ-LNDKUQBDSA-N -HMDB0008139 807.577805117 PC(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)) C46H82NO8P DCJXJVWGBOCAHZ-UZVREBQPSA-N -HMDB0008140 779.546504989 PC(18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) C44H78NO8P ZYUVFKWRZDKQNL-YHOYFWGCSA-N -HMDB0008141 779.546504989 PC(18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C44H78NO8P HZGAVPNEGHQJID-UNBCHYIMSA-N -HMDB0008144 811.609105245 PC(18:2(9Z,12Z)/20:1(11Z)) C46H86NO8P OJHJKEBRZSDTTL-VHWCKNCUSA-N -HMDB0008145 809.593455181 PC(18:2(9Z,12Z)/20:2(11Z,14Z)) C46H84NO8P ORELBRKCYWQHTL-JEHIXBSSSA-N -HMDB0008146 807.577805117 PC(18:2(9Z,12Z)/20:3(8Z,11Z,14Z)) C46H82NO8P SMIXWIPQRZURJV-GMLOEBGYSA-N -HMDB0008147 805.562155053 PC(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)) C46H80NO8P ZZSZQATYGVHNLZ-PUMLCSCDSA-N -HMDB0008148 805.562155053 PC(18:2(9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C46H80NO8P RUHBZJXWUDKAMZ-XXAGCNFXSA-N -HMDB0008157 869.687355565 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XJLHAZSETMTODV-OTCDWEGQSA-N -HMDB0008488 765.567240431 PC(20:4(8Z,11Z,14Z,17Z)/P-16:0) C44H80NO7P YNVRQZFWYTWRSS-IXSFRKHYSA-N -HMDB0008489 793.598540559 PC(20:4(8Z,11Z,14Z,17Z)/P-18:0) C46H84NO7P LHWOPLZFGPHCMJ-AMFPDOHCSA-N -HMDB0008490 791.582890495 PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(11Z)) C46H82NO7P CRMVSSHWYQUQEP-IDSBLRLXSA-N -HMDB0008491 791.582890495 PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(9Z)) C46H82NO7P ATTCDOPAYPGSLE-LQULQHAGSA-N -HMDB0008495 779.546504989 PC(20:5(5Z,8Z,11Z,14Z,17Z)/16:0) C44H78NO8P SUZYROYNFNQALJ-MHEIZRSESA-N -HMDB0008497 807.577805117 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:0) C46H82NO8P JKDOKILDEIEPFZ-LGPFJNBISA-N -HMDB0008498 805.562155053 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z)) C46H80NO8P KAAXHFGQTWYDKM-PDYZRCSUSA-N -HMDB0008499 805.562155053 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)) C46H80NO8P JZKMYCPNBSRARO-YMBRLFDISA-N -HMDB0008521 763.551590367 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-16:0) C44H78NO7P RPGDUWQZQBHLNS-XRTCNQNWSA-N -HMDB0008522 791.582890495 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:0) C46H82NO7P IWGDDCKYIXMJOA-RJFYQFCBSA-N -HMDB0008523 789.567240431 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z)) C46H80NO7P WDNOQSUMHJTAOV-RAUWIWGKSA-N -HMDB0008524 789.567240431 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(9Z)) C46H80NO7P USPBFZFHJPVLST-HALYXBRLSA-N -HMDB0008526 787.609105245 PC(22:0/14:1(9Z)) C44H86NO8P RGHFEAMZDBFLPO-FASREOMLSA-N -HMDB0008538 871.703005629 PC(22:0/20:1(11Z)) C50H98NO8P JTSFTWZTLBUFSL-ZPFYZEQDSA-N -HMDB0008539 869.687355565 PC(22:0/20:2(11Z,14Z)) C50H96NO8P LFYYYSNBZJRBSA-HHITYQTISA-N -HMDB0008542 865.656055437 PC(22:0/20:4(5Z,8Z,11Z,14Z)) C50H92NO8P YMTVBHIALYUAKW-HTJMAYPASA-N -HMDB0008543 865.656055437 PC(22:0/20:4(8Z,11Z,14Z,17Z)) C50H92NO8P BUDCKLMBPWXPIS-BVGFWLPASA-N -HMDB0008558 787.609105245 PC(22:1(13Z)/14:0) C44H86NO8P RSKUBXWDAIDNLE-HSEDGGQWSA-N -HMDB0008559 785.593455181 PC(22:1(13Z)/14:1(9Z)) C44H84NO8P CYQUGAJGPGKDFF-MHJIJCEHSA-N -HMDB0008569 871.703005629 PC(22:1(13Z)/20:0) C50H98NO8P GHUGFCZMTRWVKH-RURDTVAGSA-N -HMDB0008570 869.687355565 PC(22:1(13Z)/20:1(11Z)) C50H96NO8P RDVFINNZTUFVCO-PIUCSNMVSA-N -HMDB0008572 865.656055437 PC(22:1(13Z)/20:3(5Z,8Z,11Z)) C50H92NO8P UMAICRBPHIYESB-DNBQMDTNSA-N -HMDB0008573 865.656055437 PC(22:1(13Z)/20:3(8Z,11Z,14Z)) C50H92NO8P JPJFWRWQZROHJW-RSPSYKHISA-N -HMDB0008590 785.593455181 PC(22:2(13Z,16Z)/14:0) C44H84NO8P POKOLAWNECNRHW-JHHJWKSXSA-N -HMDB0008591 783.577805117 PC(22:2(13Z,16Z)/14:1(9Z)) C44H82NO8P AHJIOIOFNHUXKJ-GXAHKNHCSA-N -HMDB0008594 811.609105245 PC(22:2(13Z,16Z)/16:1(9Z)) C46H86NO8P GEAKOUDHDIZJPQ-UTIGHQPQSA-N -HMDB0008602 869.687355565 PC(22:2(13Z,16Z)/20:0) C50H96NO8P UGLJQXWXHNGVFA-NWFGWYPUSA-N -HMDB0008604 865.656055437 PC(22:2(13Z,16Z)/20:2(11Z,14Z)) C50H92NO8P AGTWPYRVVNKJKX-OARALLPOSA-N -HMDB0008623 781.562155053 PC(22:4(7Z,10Z,13Z,16Z)/14:0) C44H80NO8P FHBLNLYBVANDFG-CCHOKCMJSA-N -HMDB0008624 779.546504989 PC(22:4(7Z,10Z,13Z,16Z)/14:1(9Z)) C44H78NO8P UJZMLLMWTJZZJX-WPNBCRARSA-N -HMDB0008626 809.593455181 PC(22:4(7Z,10Z,13Z,16Z)/16:0) C46H84NO8P LKZIWAABXRQNGG-JAYRDFRFSA-N -HMDB0008627 807.577805117 PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) C46H82NO8P STHWQCYHQJBDDB-SYONOARRSA-N -HMDB0008635 865.656055437 PC(22:4(7Z,10Z,13Z,16Z)/20:0) C50H92NO8P MFAKYYBEUHGJJL-LFRGNPRBSA-N -HMDB0008652 793.598540559 PC(22:4(7Z,10Z,13Z,16Z)/P-16:0) C46H84NO7P QSCPZZNEQRYGTB-PZVMGWTJSA-N -HMDB0008656 779.546504989 PC(22:5(4Z,7Z,10Z,13Z,16Z)/14:0) C44H78NO8P AJLDCHCYUANNSO-WMUBFXSWSA-N -HMDB0008659 807.577805117 PC(22:5(4Z,7Z,10Z,13Z,16Z)/16:0) C46H82NO8P BKMZEBCQEFQERC-RWWOECIPSA-N -HMDB0008660 805.562155053 PC(22:5(4Z,7Z,10Z,13Z,16Z)/16:1(9Z)) C46H80NO8P ZQVQZWAPLCJLRX-SCEKUSSYSA-N -HMDB0008685 791.582890495 PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-16:0) C46H82NO7P UXEPKPPWMGCZKG-MYZUPDLISA-N -HMDB0008689 779.546504989 PC(22:5(7Z,10Z,13Z,16Z,19Z)/14:0) C44H78NO8P LPZVTJRCWZIDNE-DYPKKMQZSA-N -HMDB0008692 807.577805117 PC(22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C46H82NO8P ZEKZKKJDGPLPNX-WSRVZQLPSA-N -HMDB0008693 805.562155053 PC(22:5(7Z,10Z,13Z,16Z,19Z)/16:1(9Z)) C46H80NO8P XVZHRLZRCCOROP-CIWMBDKCSA-N -HMDB0008718 791.582890495 PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-16:0) C46H82NO7P NJQMYYBEWKAWBA-QROROJFCSA-N -HMDB0008725 805.562155053 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0) C46H80NO8P YALZVLCVXOASDL-FZGNBNATSA-N -HMDB0008751 789.567240431 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0) C46H80NO7P GJRXIEGNAMFGOV-VEOGPPBOSA-N -HMDB0008761 871.703005629 PC(24:0/18:1(11Z)) C50H98NO8P GHQRIAPHRZOTFN-IOVWWOAPSA-N -HMDB0008762 871.703005629 PC(24:0/18:1(9Z)) C50H98NO8P RPFJUYGHQKYVGN-FQUFUIAJSA-N -HMDB0008763 869.687355565 PC(24:0/18:2(9Z,12Z)) C50H96NO8P IIGQXTIUKKRHCT-WPYVRAPFSA-N -HMDB0008766 865.656055437 PC(24:0/18:4(6Z,9Z,12Z,15Z)) C50H92NO8P IETKDEZWCHUMKL-XVZQVVRQSA-N -HMDB0008786 855.708091007 PC(24:0/P-18:1(11Z)) C50H98NO7P MWPRVEPTIHJPAL-KFEZRJJJSA-N -HMDB0008787 855.708091007 PC(24:0/P-18:1(9Z)) C50H98NO7P QALXUXWZWOUOFB-WIQZAVPASA-N -HMDB0008793 871.703005629 PC(24:1(15Z)/18:0) C50H98NO8P NNYLDFXNPQLQLU-RURDTVAGSA-N -HMDB0008794 869.687355565 PC(24:1(15Z)/18:1(11Z)) C50H96NO8P NHCQXAIWNWQNKC-PRTODFFFSA-N -HMDB0008795 869.687355565 PC(24:1(15Z)/18:1(9Z)) C50H96NO8P RYDOABFPJPYSFY-JXSZFMCPSA-N -HMDB0008797 865.656055437 PC(24:1(15Z)/18:3(6Z,9Z,12Z)) C50H92NO8P GBIZLQLECZADGM-UDTGXXMFSA-N -HMDB0008798 865.656055437 PC(24:1(15Z)/18:3(9Z,12Z,15Z)) C50H92NO8P OENQWPYNVSKSGJ-XRNMTXJFSA-N -HMDB0008818 855.708091007 PC(24:1(15Z)/P-18:0) C50H98NO7P PGPURMZKEVWAFO-VMNSASLRSA-N -HMDB0008819 853.692440943 PC(24:1(15Z)/P-18:1(11Z)) C50H96NO7P XUCRMKOOPPYQFN-JFKFTMGCSA-N -HMDB0008820 853.692440943 PC(24:1(15Z)/P-18:1(9Z)) C50H96NO7P ZLQCRABYIDJNLT-AZPQEANBSA-N -HMDB0010169 703.575399814 SM(d18:1/16:0) C39H80N2O6P RWKUXQNLWDTSLO-GWQJGLRPSA-O -HMDB0010223 296.23514489 9-HODE C18H32O3 NPDSHTNEKLQQIJ-SIGMCMEVSA-N -HMDB0010379 467.301189343 LysoPC(14:0/0:0) C22H46NO7P VXUOFDJKYGDUJI-OAQYLSRUSA-N -HMDB0010384 523.363789599 LysoPC(18:0) C26H54NO7P IHNKQIMGVNPMTC-RUZDIDTESA-N -HMDB0010395 543.332489471 LysoPC(20:4(5Z,8Z,11Z,14Z)) C28H50NO7P LAXQYRRMGGEGOH-JXRLJXCWSA-N -HMDB0010396 543.332489471 LysoPC(20:4(8Z,11Z,14Z,17Z)) C28H50NO7P GOMVPVRDBLLHQC-VEJNOCSESA-N -HMDB0011151 743.582890495 PC(O-16:0/18:2(9Z,12Z)) C42H82NO7P IQACMFWAGALEAQ-WESJWMGVSA-N -HMDB0011206 717.567240431 PC(P-16:0/16:0) C40H80NO7P PEWXKAOBUSBJLD-MCBGMKGZSA-N -HMDB0011209 743.582890495 PC(P-16:0/18:1(11Z)) C42H82NO7P MVDFTRYOOPZXII-JEPFLRBFSA-N -HMDB0011210 743.582890495 PC(P-16:0/18:1(9Z)) C42H82NO7P CRBBMHQTIAELIS-KQBBALDBSA-N -HMDB0011211 741.567240431 PC(P-16:0/18:2(9Z,12Z)) C42H80NO7P QLEHHUPUHJPURI-PWYDUFMYSA-N -HMDB0011212 739.551590367 PC(P-16:0/18:3(6Z,9Z,12Z)) C42H78NO7P MNOGOEJZCHBAEJ-LGHFGPIWSA-N -HMDB0011213 739.551590367 PC(P-16:0/18:3(9Z,12Z,15Z)) C42H78NO7P WXQJKOUXCWEMOK-LUPMRSKMSA-N -HMDB0011214 737.535940303 PC(P-16:0/18:4(6Z,9Z,12Z,15Z)) C42H76NO7P DFANIYFZNIJQEP-FAVOOIQCSA-N -HMDB0011216 771.614190623 PC(P-16:0/20:1(11Z)) C44H86NO7P WXILBCFZIXHZIG-KOUVQCMKSA-N -HMDB0011217 769.598540559 PC(P-16:0/20:2(11Z,14Z)) C44H84NO7P DORCYMODRHDYER-VTLIZAISSA-N 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KMNVIRCHUMQGHD-RCINKDPXSA-N -HMDB0011242 771.614190623 PC(P-18:0/18:1(11Z)) C44H86NO7P JDTHSYITWRQVSV-CESBNGMCSA-N -HMDB0011243 771.614190623 PC(P-18:0/18:1(9Z)) C44H86NO7P DSWOVBIRJNAJAF-NVJOKYTBSA-N -HMDB0011244 769.598540559 PC(P-18:0/18:2(9Z,12Z)) C44H84NO7P PWPOLLAYFXIWOQ-PXSMKGAESA-N -HMDB0011245 767.582890495 PC(P-18:0/18:3(6Z,9Z,12Z)) C44H82NO7P QQZAQKGMSREYHF-KDEBBMLKSA-N -HMDB0011246 767.582890495 PC(P-18:0/18:3(9Z,12Z,15Z)) C44H82NO7P PYVYDRMXPDZRIS-FINMKEMFSA-N -HMDB0011247 765.567240431 PC(P-18:0/18:4(6Z,9Z,12Z,15Z)) C44H80NO7P KDEGUFHTTWTTCT-XMVXZYCSSA-N -HMDB0011251 795.614190623 PC(P-18:0/20:3(5Z,8Z,11Z)) C46H86NO7P GDXHWAGFLXXWJB-FJXNGXPBSA-N -HMDB0011252 795.614190623 PC(P-18:0/20:3(8Z,11Z,14Z)) C46H86NO7P LIRPHCPLRLOMHJ-ABWFFGIPSA-N -HMDB0011253 793.598540559 PC(P-18:0/20:4(5Z,8Z,11Z,14Z)) C46H84NO7P FHHVIBPVBBRLOR-IYACIECVSA-N -HMDB0011254 793.598540559 PC(P-18:0/20:4(8Z,11Z,14Z,17Z)) C46H84NO7P YPAPIRJFGNBODV-AMFPDOHCSA-N -HMDB0011255 791.582890495 PC(P-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C46H82NO7P JUCWIWDODRNWRN-REKGFNPQSA-N -HMDB0011264 855.708091007 PC(P-18:0/24:1(15Z)) C50H98NO7P FBDSXWIHBJVKBS-LFSKQVNVSA-N -HMDB0011267 755.619276491 PC(P-18:0/P-18:1(11Z)) C44H86NO6P DEVPFGKZYDKHPW-HAZBOWNZSA-N -HMDB0011268 755.619276491 PC(P-18:0/P-18:1(9Z)) C44H86NO6P WMOITMSBEGXTBM-XFCCLYIASA-N -HMDB0011272 743.582890495 PC(P-18:1(11Z)/16:0) C42H82NO7P MBRHHFWRXQYYAN-RTVLTNFHSA-N -HMDB0011273 741.567240431 PC(P-18:1(11Z)/16:1(9Z)) C42H80NO7P MKSPXEKLAWXUQB-YZISGTAMSA-N -HMDB0011274 771.614190623 PC(P-18:1(11Z)/18:0) C44H86NO7P JYHADTSONAUXLU-NMAVXMHBSA-N -HMDB0011275 769.598540559 PC(P-18:1(11Z)/18:1(11Z)) C44H84NO7P SOSODLPIZNSISY-WDMTWABASA-N -HMDB0011276 769.598540559 PC(P-18:1(11Z)/18:1(9Z)) C44H84NO7P AUUCOMCTAAUNNA-ASBBCAPCSA-N -HMDB0011277 767.582890495 PC(P-18:1(11Z)/18:2(9Z,12Z)) C44H82NO7P ABOXWZCNWOBUEO-DNRJJOHKSA-N -HMDB0011278 765.567240431 PC(P-18:1(11Z)/18:3(6Z,9Z,12Z)) C44H80NO7P RWVKPDIHPPTVRQ-HWGQMOSASA-N -HMDB0011279 765.567240431 PC(P-18:1(11Z)/18:3(9Z,12Z,15Z)) C44H80NO7P JPNFMUKASUYGCK-ZXWSQSGJSA-N -HMDB0011280 763.551590367 PC(P-18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C44H78NO7P DBMSAJFSJLCYLI-YAYDGDQKSA-N -HMDB0011283 795.614190623 PC(P-18:1(11Z)/20:2(11Z,14Z)) C46H86NO7P HIXAZEWYTJZKID-PYOQPOKHSA-N -HMDB0011284 793.598540559 PC(P-18:1(11Z)/20:3(5Z,8Z,11Z)) C46H84NO7P DYFGXBAIDOATAE-DSLLYOFSSA-N -HMDB0011285 793.598540559 PC(P-18:1(11Z)/20:3(8Z,11Z,14Z)) C46H84NO7P DBQMOXDLWKVKKG-REWQMPQJSA-N -HMDB0011286 791.582890495 PC(P-18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C46H82NO7P HFQNRECNIUNPMU-PAAZZWMASA-N -HMDB0011287 791.582890495 PC(P-18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C46H82NO7P HPXHHJRUVZWLFU-BKTRUPHPSA-N -HMDB0011288 789.567240431 PC(P-18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C46H80NO7P FJKJTTCPLFXVEB-VRIHKRKTSA-N -HMDB0011296 855.708091007 PC(P-18:1(11Z)/24:0) C50H98NO7P FKJFQKGICJZAJQ-XWKRXFSPSA-N -HMDB0011297 853.692440943 PC(P-18:1(11Z)/24:1(15Z)) C50H96NO7P JSYLSPXKJLUURP-AGCBSNCXSA-N -HMDB0011298 727.587976362 PC(P-18:1(11Z)/P-16:0) C42H82NO6P XLEOVOQTBCNRSS-JLFFLFAUSA-N -HMDB0011299 755.619276491 PC(P-18:1(11Z)/P-18:0) C44H86NO6P QZOQBILZVZLLKA-VXUWBODBSA-N -HMDB0011300 753.603626427 PC(P-18:1(11Z)/P-18:1(11Z)) C44H84NO6P LTQBTADUGKSCOZ-WRCNLVTNSA-N -HMDB0011301 753.603626427 PC(P-18:1(11Z)/P-18:1(9Z)) C44H84NO6P IGBGWQZLCURPQD-JNWNPKLHSA-N -HMDB0011305 743.582890495 PC(P-18:1(9Z)/16:0) C42H82NO7P IWCUEZYKNAGNRQ-ILDAMNDZSA-N -HMDB0011306 741.567240431 PC(P-18:1(9Z)/16:1(9Z)) C42H80NO7P SUJRZRVPVIAXCE-PYRHUWMFSA-N -HMDB0011307 771.614190623 PC(P-18:1(9Z)/18:0) C44H86NO7P ZOTYCHIFTCFAHC-KOUVQCMKSA-N -HMDB0011308 769.598540559 PC(P-18:1(9Z)/18:1(11Z)) C44H84NO7P PQIJYJGVCKCIRT-YLCPJMBASA-N -HMDB0011309 769.598540559 PC(P-18:1(9Z)/18:1(9Z)) C44H84NO7P DIHWZUCEXWUHOD-IIVNATNGSA-N -HMDB0011310 767.582890495 PC(P-18:1(9Z)/18:2(9Z,12Z)) C44H82NO7P GCJSAIGGRCSHDG-UWGOCUKWSA-N -HMDB0011311 765.567240431 PC(P-18:1(9Z)/18:3(6Z,9Z,12Z)) C44H80NO7P UMVUERLCXMUMBK-DSXXCHKPSA-N -HMDB0011312 765.567240431 PC(P-18:1(9Z)/18:3(9Z,12Z,15Z)) C44H80NO7P ACSIRQPNAYTBRW-CBOVKQJBSA-N -HMDB0011313 763.551590367 PC(P-18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C44H78NO7P UMDQTGZSPMWPID-CYNKDJQJSA-N -HMDB0011316 795.614190623 PC(P-18:1(9Z)/20:2(11Z,14Z)) C46H86NO7P GWBOVQHRCURSPU-QMFAPAEZSA-N -HMDB0011317 793.598540559 PC(P-18:1(9Z)/20:3(5Z,8Z,11Z)) C46H84NO7P CJYQPRLJFDUQJN-XDCBNNJESA-N -HMDB0011318 793.598540559 PC(P-18:1(9Z)/20:3(8Z,11Z,14Z)) C46H84NO7P MTMYCMNVROYPNG-URFJOBLASA-N -HMDB0011319 791.582890495 PC(P-18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C46H82NO7P HNUHLIYPMNZVJJ-HCMWKDOBSA-N -HMDB0011320 791.582890495 PC(P-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C46H82NO7P KMIAOCFPRZDKBX-NDLZGGRQSA-N -HMDB0011321 789.567240431 PC(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C46H80NO7P ZODCGHWSTRZXKA-HALYXBRLSA-N -HMDB0011329 855.708091007 PC(P-18:1(9Z)/24:0) C50H98NO7P GJCSGDXRDRUPGA-NOOMALMASA-N -HMDB0011330 853.692440943 PC(P-18:1(9Z)/24:1(15Z)) C50H96NO7P MHYVCIAEFGWAIU-SKTGCJPMSA-N -HMDB0011331 727.587976362 PC(P-18:1(9Z)/P-16:0) C42H82NO6P DKCXAWVKSPBFRB-BCZCSWKFSA-N -HMDB0011332 755.619276491 PC(P-18:1(9Z)/P-18:0) C44H86NO6P YJTJKQOTVSAOSY-NZPQLVOLSA-N -HMDB0011333 753.603626427 PC(P-18:1(9Z)/P-18:1(11Z)) C44H84NO6P AONWYGCJCICSCF-UVRXSTQASA-N -HMDB0011334 753.603626427 PC(P-18:1(9Z)/P-18:1(9Z)) C44H84NO6P WBQMXDUFWFHART-DZZHLSRZSA-N -HMDB0011469 74.073164942 2-Butanol C4H10O BTANRVKWQNVYAZ-UHFFFAOYSA-N -HMDB0011619 298.323565966 "Arachidyl alcohol" C20H42O BTFJIXJJCSYFAL-UHFFFAOYSA-N -HMDB0011623 156.151415262 Decanal C10H20O KSMVZQYAVGTKIV-UHFFFAOYSA-N -HMDB0011625 137.966200885 Dimethylarsinate C2H7AsO2 OGGXGZAMXPVRFZ-UHFFFAOYSA-N -HMDB0011626 186.198365454 Dodecanol C12H26O LQZZUXJYWNFBMV-UHFFFAOYSA-N -HMDB0011635 188.014329434 "p-Cresol sulfate" C7H8O4S WGNAKZGUSRVWRH-UHFFFAOYSA-N -HMDB0011697 815.700600326 SM(d18:1/24:0) C47H96N2O6P QEDPUVGSSDPBMD-XTAIVQBESA-O -HMDB0011724 124.0524295 "4-Hydroxybenzyl alcohol" C7H8O2 BVJSUAQZOZWCKN-UHFFFAOYSA-N -HMDB0011733 132.053492132 Glycyl-glycine C4H8N2O3 YMAWOPBAYDPSLA-UHFFFAOYSA-N -HMDB0011745 191.061613977 N-Acetyl-L-methionine C7H13NO3S XUYPXLNMDZIRQH-UHFFFAOYSA-N -HMDB0011749 99.068413915 2-Piperidinone C5H9NO XUWHAWMETYGRKB-UHFFFAOYSA-N -HMDB0011756 173.105193351 N-Acetylleucine C8H15NO3 WXNXCEHXYPACJF-ZETCQYMHSA-N -HMDB0012101 728.583224846 SM(d18:1/18:1(9Z)) C41H81N2O6P NBEADXWAAWCCDG-QDDWGVBQSA-N -HMDB0012107 812.67712523 SM(d18:1/24:1(15Z)) C47H93N2O6P WKZHECFHXLTOLJ-QYKFWSDSSA-N -HMDB0012136 75.068413915 1-Amino-propan-2-ol C3H9NO HXKKHQJGJAFBHI-UHFFFAOYSA-N -HMDB0012141 134.057908808 (R)-2,3-Dihydroxy-isovalerate C5H10O4 JTEYKUFKXGDTEU-VKHMYHEASA-N -HMDB0012154 159.089543287 3-Dehydrocarnitine C7H13NO3 YNOWULSFLVIUDH-UHFFFAOYSA-N -HMDB0012308 152.047344122 Vanillin C8H8O3 MWOOGOJBHIARFG-UHFFFAOYSA-N -HMDB0012328 254.224580204 "Palmitelaidic acid" C16H30O2 SECPZKHBENQXJG-BQYQJAHWSA-N -HMDB0012843 132.07864425 "6-Hydroxyhexanoic acid" C6H12O3 IWHLYPDWHHPVAA-UHFFFAOYSA-N -HMDB0012971 102.10446507 1-Hexanol C6H14O ZSIAUFGUXNUGDI-UHFFFAOYSA-N -HMDB0013036 88.088815006 1-Pentanol C5H12O AMQJEAYHLZJPGS-UHFFFAOYSA-N -HMDB0013124 215.115758037 Propenoylcarnitine C10H17NO4 YUCNWOKTRWJLGY-QMMMGPOBSA-N -HMDB0013131 275.173272915 Hydroxyhexanoycarnitine C13H25NO5 VYEONLJQPYRKAN-DTIOYNMSSA-N -HMDB0013302 312.147392516 Phenylalanylphenylalanine C18H20N2O3 GKZIWHRNKRBEOH-UHFFFAOYSA-N -HMDB0013334 395.303558805 9,12-Hexadecadienoylcarnitine C23H41NO4 AHZCIODFJPNPKS-XBDLETADSA-N -HMDB0013404 717.567240431 PC(o-16:0/16:1(9Z)) C40H80NO7P HJVQHTGUAIETCQ-VEAYGOGPSA-N -HMDB0013405 747.614190623 PC(o-16:0/18:0) C42H86NO7P PXPSGTINXJQLBR-VQJSHJPSSA-N -HMDB0013407 767.582890495 PC(o-16:0/20:4(8Z,11Z,14Z,17Z)) C44H82NO7P SOUZQPFUXRVDGK-KCTKZSJBSA-N -HMDB0013408 803.676790879 PC(o-16:0/22:0) C46H94NO7P BIIIEBBIUJYGBZ-WBVITSLISA-N -HMDB0013412 745.598540559 PC(o-16:1(9Z)/18:0) C42H84NO7P SVSLBZPEDBYFGG-HVLKLTLRSA-N -HMDB0013414 773.629840687 PC(o-16:1(9Z)/20:0) C44H88NO7P NEMVGIRAGVGOLH-RPBJOJELSA-N -HMDB0013418 771.614190623 PC(o-18:0/18:2(9Z,12Z)) C44H86NO7P LMGTVCKIUNTOEP-HJTCUGKVSA-N -HMDB0013419 803.676790879 PC(o-18:0/20:0) C46H94NO7P BVCZSMAYNCVQDT-WBVITSLISA-N -HMDB0013420 795.614190623 PC(o-18:0/20:4(8Z,11Z,14Z,17Z)) C46H86NO7P GBNPCIWXLWZJGA-IGBSIYCFSA-N -HMDB0013424 745.598540559 PC(o-18:1(11Z)/16:0) C42H84NO7P QCGUXAIDEOWPBV-SNKLRXETSA-N -HMDB0013425 769.598540559 PC(o-18:1(11Z)/18:2(9Z,12Z)) C44H84NO7P KBRIWDRDGVERBB-VXKJXORPSA-N -HMDB0013426 745.598540559 PC(o-18:1(9Z)/16:0) C42H84NO7P IQLHTKSHLGLPMG-HFWGUVFESA-N -HMDB0013427 773.629840687 PC(o-18:1(9Z)/18:0) C44H88NO7P KKPRQPUSFKIYMO-GRVDSVFJSA-N -HMDB0013428 771.614190623 PC(o-18:1(9Z)/18:1(11Z)) C44H86NO7P GSROTDACALJGFK-YIFANWOHSA-N -HMDB0013429 769.598540559 PC(o-18:1(9Z)/18:2(9Z,12Z)) C44H84NO7P MFZLAZYUXHHSIA-HVODBARTSA-N -HMDB0013432 793.598540559 PC(o-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C46H84NO7P VJNPDLZENXBRLB-MQEDXBOASA-N -HMDB0013435 767.582890495 PC(o-18:2(9Z,12Z)/18:2(9Z,12Z)) C44H82NO7P XCCONPVPHCCYNF-KPFPPAHTSA-N -HMDB0013437 827.676790879 PC(o-18:2(9Z,12Z)/22:0) C48H94NO7P DMPIMBNFIDOLGO-DTRJYZOJSA-N -HMDB0013438 855.708091007 PC(o-18:2(9Z,12Z)/24:0) C50H98NO7P SJLRNWKFILQPDM-AARZFCJCSA-N -HMDB0013439 797.629840687 PC(o-20:0/18:3(6Z,9Z,12Z)) C46H88NO7P XHKFHCCQLHPBPZ-WKDUQDSSSA-N -HMDB0013440 797.629840687 PC(o-20:0/18:3(9Z,12Z,15Z)) C46H88NO7P APWUUZRAVVATRC-GBRUYZQDSA-N -HMDB0013444 821.629840687 PC(o-20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C48H88NO7P UNAQSIZPRIMCTB-QXUJVPJQSA-N -HMDB0013449 881.723741071 PC(o-22:0/22:3(10Z,13Z,16Z)) C52H100NO7P CQBVYLALIKLMGX-TYGMOWAISA-N -HMDB0013452 881.723741071 PC(o-22:1(13Z)/22:2(13Z,16Z)) C52H100NO7P VCODWVLGDPOACA-DRGSQYEJSA-N -HMDB0013453 879.708091007 PC(o-22:1(13Z)/22:3(10Z,13Z,16Z)) C52H98NO7P ADCPDRAGQLKVRI-DFPONBFASA-N -HMDB0013455 879.708091007 PC(o-22:2(13Z,16Z)/22:2(13Z,16Z)) C52H98NO7P GCAMFMBVIXVYSA-VIVKCUGUSA-N -HMDB0013456 877.692440943 PC(o-22:2(13Z,16Z)/22:3(10Z,13Z,16Z)) C52H96NO7P CEZAZXUWDFPTTE-FHIJIHMSSA-N -HMDB0013458 853.692440943 PC(o-24:0/18:3(6Z,9Z,12Z)) C50H96NO7P LDFITNYTODJQBW-AQBSXLNYSA-N -HMDB0013459 853.692440943 PC(o-24:0/18:3(9Z,12Z,15Z)) C50H96NO7P NIIFWBWRLRQUHB-LSTCNRAPSA-N -HMDB0013460 879.708091007 PC(o-24:0/20:4(8Z,11Z,14Z,17Z)) C52H98NO7P AQJDGYZOTXPNFY-ZFRXABNDSA-N -HMDB0013461 840.708425358 SM(d18:1/26:1(17Z)) C49H97N2O6P YXEXWUZHFGYOHJ-UOJCCMJYSA-N -HMDB0013463 716.54683934 SM(d18:0/16:1(9Z)(OH)) C39H77N2O7P LPHMSPONPQCKTL-FKUNDBCPSA-N -HMDB0013464 702.567574782 SM(d18:0/16:1(9Z)) C39H79N2O6P CGVOQSQIYSUXAT-PPLFXBRHSA-N -HMDB0013466 800.640739724 SM(d18:0/22:1(13Z)(OH)) C45H89N2O7P ZUSFLIGNJFDBRL-FYGIKZFGSA-N -HMDB0013467 798.62508966 SM(d18:0/22:2(13Z,16Z)(OH)) C45H87N2O7P DRKCMBAZIYFIGX-ZWLRGCNFSA-N -HMDB0013469 828.672039852 SM(d18:0/24:1(15Z)(OH)) C47H93N2O7P IOOMOQUTKQGEFH-BSZNTFKYSA-N -HMDB0013667 88.905847902 Yttrium Y VWQVUPCCIRVNHF-UHFFFAOYSA-N -HMDB0013669 132.90544687 Cesium Cs TVFDJXOCXUVLDH-UHFFFAOYSA-N -HMDB0013670 105.903483087 Palladium Pd KDLHZDBZIXYQEI-UHFFFAOYSA-N -HMDB0013671 194.964774449 Platinum Pt BASFCYQUMIYNBI-UHFFFAOYSA-N -HMDB0013672 139.905434035 Cerium Ce GWXLDORMOJMVQZ-UHFFFAOYSA-N -HMDB0013711 138.90634816 Lanthanum La FZLIPJUXYLNCLC-UHFFFAOYSA-N -HMDB0013715 141.907718643 Neodymium Nd QEFYFXOXNSNQGX-UHFFFAOYSA-N -HMDB0013724 239.943281 Thallium ClTl GBECUEIQVRDUKB-UHFFFAOYSA-M -HMDB0013780 125.963162262 "Dimethyl trisulfide" C2H6S3 YWHLKYXPLRWGSE-UHFFFAOYSA-N -HMDB0013824 138.10446507 2-Pentylfuran C9H14O YVBAUDVGOFCUSG-UHFFFAOYSA-N -HMDB0015016 504.203196424 Chlorhexidine C22H30Cl2N10 GHXZTYHSJHQHIJ-UHFFFAOYSA-N -HMDB0015144 254.094294314 Ketoprofen C16H14O3 DKYWVDODHFEZIM-UHFFFAOYSA-N -HMDB0015532 63.929146578 Zinc Zn HCHKCACWOHOZIP-UHFFFAOYSA-N -HMDB0028690 202.131742452 Alanyl-Isoleucine C9H18N2O3 ZSOICJZJSRWNHX-UHFFFAOYSA-N -HMDB0028691 202.131742452 Alanyl-Leucine C9H18N2O3 RDIKFPRVLJLMER-UHFFFAOYSA-N -HMDB0028695 186.100442324 Alanyl-Proline C8H14N2O3 WPWUFUBLGADILS-UHFFFAOYSA-N -HMDB0028700 188.116092383 Alanyl-Valine C8H16N2O3 LIWMQSWFLXEGMA-WDSKDSINSA-N -HMDB0028816 250.062342733 Glutamylcysteine C8H14N2O5S PABVKUJVLNMOJP-WHFBIAKZSA-N -HMDB0028844 188.116092388 Glycyl-Isoleucine C8H16N2O3 KGVHCTWYMPWEGN-UHFFFAOYSA-N -HMDB0028848 222.100442324 Glycyl-Phenylalanine C11H14N2O3 JBCLFWXMTIKCCB-UHFFFAOYSA-N -HMDB0028853 238.095356939 Glycyltyrosine C11H14N2O4 XBGGUPMXALFZOT-VIFPVBQESA-N -HMDB0028854 174.100442324 Glycyl-Valine C7H14N2O3 STKYPAFSDFAEPH-UHFFFAOYSA-N -HMDB0028910 244.178692644 Isoleucyl-Isoleucine C12H24N2O3 BCVIOZZGJNOEQS-UHFFFAOYSA-N -HMDB0028911 244.178692644 Isoleucyl-Leucine C12H24N2O3 JWBXCSQZLLIOCI-UHFFFAOYSA-N -HMDB0028932 244.178692644 Leucyl-Isoleucine C12H24N2O3 AZLASBBHHSLQDB-UHFFFAOYSA-N -HMDB0028933 244.178692644 Leucyl-Leucine C12H24N2O3 LCPYQJIKPJDLLB-UHFFFAOYSA-N -HMDB0029068 266.126657074 Threoninyl-Phenylalanine C13H18N2O4 IQHUITKNHOKGFC-UHFFFAOYSA-N -HMDB0029126 246.121571688 Valyl-Glutamate C10H18N2O5 UPJONISHZRADBH-UHFFFAOYSA-N -HMDB0029201 179.94654876 Hafnium Hf VBJZVLUMGGDVMO-UHFFFAOYSA-N -HMDB0029595 128.15650064 Nonane C9H20 BKIMMITUMNQMOS-UHFFFAOYSA-N -HMDB0029596 117.914383153 Chloroform CHCl3 HEDRZPFGACZZDS-UHFFFAOYSA-N -HMDB0029597 84.093900384 Cyclohexane C6H12 XDTMQSROBMDMFD-UHFFFAOYSA-N -HMDB0029600 86.109550448 Hexane C6H14 VLKZOEOYAKHREP-UHFFFAOYSA-N -HMDB0029635 136.0524295 "4-Methylbenzoic acid" C8H8O2 LPNBBFKOUUSUDB-UHFFFAOYSA-N -HMDB0029638 120.057514878 4-Methylbenzaldehyde C8H8O FXLOVSHXALFLKQ-UHFFFAOYSA-N -HMDB0029641 132.093900384 p-Mentha-1,3,5,8-tetraene C10H12 MMSLOZQEMPDGPI-UHFFFAOYSA-N -HMDB0029672 138.068079564 1,3-Dimethoxybenzene C8H10O2 DPZNOMCNRMUKPS-UHFFFAOYSA-N -HMDB0029686 136.0524295 4-Methoxybenzaldehyde C8H8O2 ZRSNZINYAWTAHE-UHFFFAOYSA-N -HMDB0029713 84.998619791 Thiazole C3H3NS FZWLAAWBMGSTSO-UHFFFAOYSA-N -HMDB0029723 182.999013721 Saccharin C7H5NO3S CVHZOJJKTDOEJC-UHFFFAOYSA-N -HMDB0029751 128.062600256 Naphthalene C10H8 UFWIBTONFRDIAS-UHFFFAOYSA-N -HMDB0030062 88.0524295 "Methyl propionate" C4H8O2 RJUFJBKOKNCXHH-UHFFFAOYSA-N -HMDB0030088 136.125200512 cis-Ocimene C10H16 IHPKGUQCSIINRJ-NTMALXAHSA-N -HMDB0030089 136.125200512 trans-Ocimen C10H16 IHPKGUQCSIINRJ-CSKARUKUSA-N -HMDB0030469 242.224580204 "Methyl tetradecanoate" C15H30O2 ZAZKJZBWRNNLDS-UHFFFAOYSA-N -HMDB0030837 148.088815006 Anethole C10H12O RUVINXPYWBROJD-ARJAWSKDSA-N -HMDB0030924 212.214015518 2-Tetradecanone C14H28O POQLVOYRGNFGRM-UHFFFAOYSA-N -HMDB0030928 198.198365454 Tridecanal C13H26O BGEHHAVMRVXCGR-UHFFFAOYSA-N -HMDB0030941 170.167065326 Undecanal C11H22O KMPQYAYAQWNLME-UHFFFAOYSA-N -HMDB0031019 184.18271539 2-Dodecanone C12H24O LSKONYYRONEBKA-UHFFFAOYSA-N -HMDB0031046 268.240230268 "9E-Heptadecenoic acid" C17H32O2 QSBYPNXLFMSGKH-CMDGGOBGSA-N -HMDB0031081 226.229665582 2-Pentadecanone C15H30O CJPNOLIZCWDHJK-UHFFFAOYSA-N -HMDB0031158 114.068079564 "2-Methyl-4-pentenoic acid" C6H10O2 HVRZYSHVZOELOH-UHFFFAOYSA-N -HMDB0031206 86.073164942 Pentanal C5H10O HGBOYTHUEUWSSQ-UHFFFAOYSA-N -HMDB0031217 88.0524295 "Ethyl acetate" C4H8O2 XEKOWRVHYACXOJ-UHFFFAOYSA-N -HMDB0031231 130.135765198 xi-2-Ethyl-1-hexanol C8H18O YIWUKEYIRIRTPP-UHFFFAOYSA-N -HMDB0031241 102.068079564 "Isopropyl acetate" C5H10O2 JMMWKPVZQRWMSS-UHFFFAOYSA-N -HMDB0031266 142.135765198 2-Nonanone C9H18O VKCYHJWLYTUGCC-UHFFFAOYSA-N -HMDB0031269 140.120115134 2-Nonenal C9H16O BSAIUMLZVGUGKX-FPLPWBNLSA-N -HMDB0031293 142.099379692 2,3-Octanedione C8H14O2 XCBBNTFYSLADTO-UHFFFAOYSA-N -HMDB0031294 128.120115134 2-Octanone C8H16O ZPVFWPFBNIEHGJ-UHFFFAOYSA-N -HMDB0031295 128.120115134 "Ethyl pentyl ketone" C8H16O RHLVCLIPMVJYKS-UHFFFAOYSA-N -HMDB0031296 128.120115134 (E)-2-Octen-1-ol C8H16O AYQPVPFZWIQERS-SREVYHEPSA-N -HMDB0031309 126.10446507 1-Octen-3-one C8H14O KLTVSWGXIAYTHO-UHFFFAOYSA-N -HMDB0031310 150.068079564 "Benzyl acetate" C9H10O2 QUKGYYKBILRGFE-UHFFFAOYSA-N -HMDB0031313 202.135765198 2-Pentyl-3-phenyl-2-propenal C14H18O HMKKIXGYKWDQSV-KAMYIIQDSA-N -HMDB0031409 156.151415262 2-Decanone C10H20O ZAJNGDIORYACQU-UHFFFAOYSA-N -HMDB0031429 114.10446507 2,4-Dimethyl-3-pentanone C7H14O HXVNBWAKAOHACI-UHFFFAOYSA-N -HMDB0031444 170.203450832 N-Dodecane C12H26 SNRUBQQJIBEYMU-UHFFFAOYSA-N -HMDB0031445 156.187800768 Undecane C11H24 RSJKGSCJYJTIGS-UHFFFAOYSA-N -HMDB0031447 100.125200512 N-Heptane C7H16 IMNFDUFMRHMDMM-UHFFFAOYSA-N -HMDB0031450 142.172150704 N-Decane C10H22 DIOQZVSQGTUSAI-UHFFFAOYSA-N -HMDB0031454 164.120115134 trans-Jasmone C11H16O XMLSXPIVAXONDL-SNAWJCMRSA-N -HMDB0031475 114.10446507 Heptanal C7H14O FXHGMKSSBGDXIY-UHFFFAOYSA-N -HMDB0031476 128.083729628 2,3-Heptanedione C7H12O2 FJPGAMCQJNLTJC-UHFFFAOYSA-N -HMDB0031491 114.068079564 2,3-Hexanedione C6H10O2 MWVFCEVNXHTDNF-UHFFFAOYSA-N -HMDB0031493 102.10446507 3-Hexanol C6H14O ZOCHHNOQQHDWHG-UHFFFAOYSA-N -HMDB0031496 98.073164942 2-Hexenal C6H10O MBDOYVRWFFCFHM-UHFFFAOYSA-N -HMDB0031512 84.057514878 "Tiglic aldehyde" C5H8O ACWQBUSCFPJUPN-HYXAFXHYSA-N -HMDB0031523 74.036779436 "Methyl acetate" C3H6O2 KXKVLQRXCPHEJC-UHFFFAOYSA-N -HMDB0031526 86.073164942 (±)-2-Methylbutanal C5H10O BYGQBDHUGHBGMD-UHFFFAOYSA-N -HMDB0031530 84.057514878 3-Methyl-3-buten-2-one C5H8O ZGHFDIIVVIFNPS-UHFFFAOYSA-N -HMDB0031531 156.115029756 Dihydro-5-pentyl-2(3H)-furanone C9H16O2 OALYTRUKMRCXNH-UHFFFAOYSA-N -HMDB0031542 84.093900384 Methylcyclopentane C6H12 GDOPTJXRTPNYNR-UHFFFAOYSA-N -HMDB0031548 83.953355478 Dichloromethane CH2Cl2 YMWUJEATGCHHMB-UHFFFAOYSA-N -HMDB0031549 114.10446507 5-Methyl-2-hexanone C7H14O FFWSICBKRCICMR-UHFFFAOYSA-N -HMDB0031563 98.073164942 "4-Methyl-3-penten-2-one, 9CI" C6H10O SHOJXDKTYKFBRD-UHFFFAOYSA-N -HMDB0031566 146.073164942 2-Methyl-3-phenyl-2-propenal C10H10O VLUMOWNVWOXZAU-CLFYSBASSA-N -HMDB0031578 100.088815006 2-Methylpentanal C6H12O FTZILAQGHINQQR-UHFFFAOYSA-N -HMDB0031583 114.140850576 3-Methylheptane C8H18 LAIUFBWHERIJIH-UHFFFAOYSA-N -HMDB0031598 100.0524295 2,3-Pentanedione C5H8O2 TZMFJUDUGYTVRY-UHFFFAOYSA-N -HMDB0031607 84.057514878 1-Penten-3-one C5H8O JLIDVCMBCGBIEY-UHFFFAOYSA-N -HMDB0031630 44.062600256 Propane C3H8 ATUOYWHBWRKTHZ-UHFFFAOYSA-N -HMDB0031635 74.019020882 2-Propene-1-thiol C3H6S ULIKDJVNUXNQHS-UHFFFAOYSA-N -HMDB0031647 72.021129372 "Acrylic acid" C3H4O2 NIXOWILDQLNWCW-UHFFFAOYSA-N -HMDB0031653 88.034670946 3-(Methylthio)-1-propene C4H8S NVLPQIPTCCLBEU-UHFFFAOYSA-N -HMDB0031681 128.083729628 Dihydro-5-propyl-2(3H)-furanone C7H12O2 VLSVVMPLPMNWBH-UHFFFAOYSA-N -HMDB0031685 138.10446507 2,4-Nonadienal C9H14O ZHHYXNZJDGDGPJ-MDAAKZFYSA-N -HMDB0031736 216.151415262 2-Hexyl-3-phenyl-2-propenal C15H20O GUUHFMWKWLOQMM-NTCAYCPXSA-N -HMDB0031740 226.15689457 "Methyl dihydrojasmonate" C13H22O3 KVWWIYGFBYDJQC-GHMZBOCLSA-N -HMDB0032049 182.073164942 Benzophenone C13H10O RWCCWEUUXYIKHB-UHFFFAOYSA-N -HMDB0032051 196.146329884 "alpha-Terpineol acetate" C12H20O2 IGODOXYLBBXFDW-UHFFFAOYSA-N -HMDB0032072 132.057514878 (Z)-3-Phenyl-2-propenal C9H8O KJPRLNWUNMBNBZ-DAXSKMNVSA-N -HMDB0032562 169.089149357 Diphenylamine C12H11N DMBHHRLKUKUOEG-UHFFFAOYSA-N -HMDB0032572 152.047344122 Methylparaben C8H8O3 LXCFILQKKLGQFO-UHFFFAOYSA-N -HMDB0032610 168.093900384 4-Methylbiphenyl C13H12 ZZLCFHIKESPLTH-UHFFFAOYSA-N -HMDB0032619 122.073164942 1-Phenylethanol C8H10O WAPNOHKVXSQRPX-UHFFFAOYSA-N -HMDB0032626 150.10446507 1-Methoxy-4-propylbenzene C10H14O KBHWKXNXTURZCD-UHFFFAOYSA-N -HMDB0032965 96.057514878 2,4-Dimethylfuran C6H8O AABTWRKUKUPMJG-UHFFFAOYSA-N -HMDB0033567 196.219100896 Cyclotetradecane C14H28 KATXJJSCAPBIOB-UHFFFAOYSA-N -HMDB0033713 170.167065326 2-Undecanone C11H22O KYWIYKKSMDLRDC-UHFFFAOYSA-N -HMDB0033714 98.073164942 2-Methyl-2-pentenal C6H10O IDEYZABHVQLHAF-XQRVVYSFSA-N -HMDB0033721 254.297351216 Octadecane C18H38 RZJRJXONCZWCBN-UHFFFAOYSA-N -HMDB0033742 102.068079564 "(S)-2-Methylbutanoic acid" C5H10O2 WLAMNBDJUVNPJU-BYPYZUCNSA-N -HMDB0033788 228.20893014 "Ethyl dodecanoate" C14H28O2 MMXKVMNBHPAILY-UHFFFAOYSA-N -HMDB0033792 226.266051088 Hexadecane C16H34 DCAYPVUWAIABOU-UHFFFAOYSA-N -HMDB0033826 220.18271539 2,6-Di-tert-butyl-4-methylphenol C15H24O NLZUEZXRPGMBCV-UHFFFAOYSA-N -HMDB0033827 112.088815006 (2E)-2-Heptenal C7H12O NDFKTBCGKNOHPJ-AATRIKPKSA-N -HMDB0033910 120.057514878 Acetophenone C8H8O KWOLFJPFCHCOCG-UHFFFAOYSA-N -HMDB0033933 184.18271539 "Lauric aldehyde" C12H24O HFJRKMMYBMWEAD-UHFFFAOYSA-N -HMDB0034029 120.093900384 Isopropylbenzene C9H12 RWGFKTVRMDUZSP-UHFFFAOYSA-N -HMDB0034121 148.088815006 1-Methoxy-4-(2-propenyl)benzene C10H12O ZFMSMUAANRJZFM-UHFFFAOYSA-N -HMDB0034148 198.198365454 2-Tridecanone C13H26O CYIFVRUOHKNECG-UHFFFAOYSA-N -HMDB0034168 92.062600256 Toluene C7H8 YXFVVABEGXRONW-UHFFFAOYSA-N -HMDB0034220 180.063388116 Levoinositol C6H12O6 CDAISMWEOUEBRE-SHFUYGGZSA-N -HMDB0034233 70.041864814 (E)-2-Butenal C4H6O MLUCVPSAIODCQM-IHWYPQMZSA-N -HMDB0034235 86.073164942 2-Pentanone C5H10O XNLICIUVMPYHGG-UHFFFAOYSA-N -HMDB0034237 102.068079564 "Propyl acetate" C5H10O2 YKYONYBAUNKHLG-UHFFFAOYSA-N -HMDB0034240 104.062600256 Styrene C8H8 PPBRXRYQALVLMV-UHFFFAOYSA-N -HMDB0034282 338.3912516 Lignocerane C24H50 POOSGDOYLQNASK-UHFFFAOYSA-N -HMDB0034283 212.214015518 Tetradecanal C14H28O UHUFTBALEZWWIH-UHFFFAOYSA-N -HMDB0034284 184.219100896 Tridecane C13H28 IIYFAKIEWZDVMP-UHFFFAOYSA-N -HMDB0034289 268.31300128 Nonadecane C19H40 LQERIDTXQFOHKA-UHFFFAOYSA-N -HMDB0034296 310.28718046 "11-Eicosenoic acid" C20H38O2 BITHHVVYSMSWAG-UHFFFAOYSA-N -HMDB0034297 298.250794954 "Ricinoleic acid" C18H34O3 WBHHMMIMDMUBKC-XFXZXTDPSA-N -HMDB0034301 85.089149357 Piperidine C5H11N NQRYJNQNLNOLGT-UHFFFAOYSA-N -HMDB0034365 174.100442324 L-Theanine C7H14N2O3 DATAGRPVKZEWHA-YFKPBYRVSA-N -HMDB0034446 170.073164942 "Diphenyl ether" C12H10O USIUVYZYUHIAEV-UHFFFAOYSA-N -HMDB0034769 44.006959742 "Boric acid (HBO2)" BHO2 VGTPKLINSHNZRD-UHFFFAOYSA-N -HMDB0034975 152.120115134 Piperitone C10H16O YSTPAHQEHQSRJD-UHFFFAOYSA-N -HMDB0034976 154.135765198 (-)-Borneol C10H18O DTGKSKDOIYIVQL-QXFUBDJGSA-N -HMDB0035078 152.120115135 Geranial C10H16O WTEVQBCEXWBHNA-JXMROGBWSA-N -HMDB0035084 204.187800773 (+)-1(10),4-Cadinadiene C15H24 FUCYIEXQVQJBKY-ZFWWWQNUSA-N -HMDB0035155 154.1357652 beta-Geraniol C10H18O GLZPCOQZEFWAFX-JXMROGBWSA-N -HMDB0035226 124.0524295 2-Acetyl-5-methylfuran C7H8O2 KEFJLCGVTHRGAH-UHFFFAOYSA-N -HMDB0035474 298.28718046 "Isopropyl hexadecanoate" C19H38O2 XUGNVMKQXJXZCD-UHFFFAOYSA-N -HMDB0035604 152.120115134 Pulegone C10H16O NZGWDASTMWDZIW-MRVPVSSYSA-N -HMDB0035625 136.125200512 (-)-7,7-Dimethyl-2-methylenebicyclo[2.2.1]heptane C10H16 XCPQUQHBVVXMRQ-UHFFFAOYSA-N -HMDB0035658 136.125200512 (-)-alpha-Pinene C10H16 GRWFGVWFFZKLTI-RKDXNWHRSA-N -HMDB0035818 154.135765198 (+)-Borneol C10H18O DTGKSKDOIYIVQL-QXFUBDJGSA-N -HMDB0035824 150.104465071 Carvone C10H14O ULDHMXUKGWMISQ-UHFFFAOYSA-N -HMDB0035825 154.135765198 (-)-Dihydrocarveol C10H18O KRCZYMFUWVJCLI-MGRQHWMJSA-N -HMDB0035850 136.125200515 alpha-Phellandrene C10H16 OGLDWXZKYODSOB-UHFFFAOYSA-N -HMDB0035915 126.10446507 Sulcatone C8H14O UHEPJGULSIKKTP-UHFFFAOYSA-N -HMDB0035924 67.042199165 Pyrrole C4H5N KAESVJOAVNADME-UHFFFAOYSA-N -HMDB0036079 152.120115134 Dihydrocarvone C10H16O AZOCECCLWFDTAP-UHFFFAOYSA-N -HMDB0036080 152.120115134 (1S,4S)-Dihydrocarvone C10H16O AZOCECCLWFDTAP-IUCAKERBSA-N -HMDB0036081 136.125200515 beta-Phellandrene C10H16 LFJQCDVYDGGFCH-UHFFFAOYSA-N -HMDB0036089 150.10446507 (R)-Menthofuran C10H14O YGWKXXYGDYYFJU-UHFFFAOYSA-N -HMDB0036209 130.099379692 "Propyl 2-methylpropanoate" C7H14O2 AZFUASHXSOTBNU-UHFFFAOYSA-N -HMDB0036219 214.193280076 "Octyl 2-methylbutyrate" C13H26O2 BCOJVEMHTBSAOE-UHFFFAOYSA-N -HMDB0036413 204.187800768 alpha-Cubebene C15H24 XUEHVOLRMXNRKQ-UHFFFAOYSA-N -HMDB0036453 200.15650064 3,4-Dihydrocadalene C15H20 CUUMXRBKJIDIAY-UHFFFAOYSA-N -HMDB0036560 136.125200515 beta-Pinene C10H16 WTARULDDTDQWMU-UHFFFAOYSA-N -HMDB0036565 192.151415262 beta-Ionone C13H20O PSQYTAPXSHCGMF-BQYQJAHWSA-N -HMDB0036574 75.94414138 "Carbon disulfide" CS2 QGJOPFRUJISHPQ-UHFFFAOYSA-N -HMDB0036731 204.187800768 beta-Neoclovene C15H24 BUDWHMNUSAOQBI-UHFFFAOYSA-N -HMDB0036792 204.187800773 beta-Caryophyllene C15H24 NPNUFJAVOOONJE-GFUGXAQUSA-N -HMDB0036811 302.224580204 "Isopimaric acid" C20H30O2 MXYATHGRPJZBNA-UHFFFAOYSA-N -HMDB0036993 154.1357652 gamma-Terpineol C10H18O NNRLDGQZIVUQTE-UHFFFAOYSA-N -HMDB0036995 136.125200515 alpha-Terpinene C10H16 YHQGMYUVUMAZJR-UHFFFAOYSA-N -HMDB0036997 136.125200512 beta-Terpinene C10H16 SCWPFSIZUZUCCE-UHFFFAOYSA-N -HMDB0037013 134.109550448 p-Mentha-1,3,8-triene C10H14 XNMPFDIYAMOYRM-UHFFFAOYSA-N -HMDB0037050 134.109550448 1-Isopropyl-2-methylbenzene C10H14 WWRCMNKATXZARA-UHFFFAOYSA-N -HMDB0037213 138.140850576 xi-p-Menth-3-ene C10H18 YYCPSEFQLGXPCO-UHFFFAOYSA-N -HMDB0037268 156.187800768 xi-4-Methyldecane C11H24 DVWZNKLWPILULD-UHFFFAOYSA-N -HMDB0037784 204.187800773 (+)-alpha-Muurolene C15H24 QMAYBMKBYCGXDH-UHFFFAOYSA-N -HMDB0037790 62.036779436 "Polyethylene glycol" C2H6O2 LYCAIKOWRPUZTN-UHFFFAOYSA-N -HMDB0038121 136.125200515 1,7,7-Trimethyltricyclo[2.2.1.02,6]heptane C10H16 RRBYUSWBLVXTQN-UHFFFAOYSA-N -HMDB0038155 204.187800768 beta-Bourbonene C15H24 YIRAHEODBQONHI-UHFFFAOYSA-N -HMDB0038169 136.125200515 7-Methyl-3-methylene-1,6-octadiene C10H16 UAHWPYUMFXYFJY-UHFFFAOYSA-N -HMDB0038206 204.187800773 gamma-Muurolene C15H24 WRHGORWNJGOVQY-UHFFFAOYSA-N -HMDB0038207 204.187800768 gamma-Cadinene C15H24 WRHGORWNJGOVQY-KKUMJFAQSA-N -HMDB0038311 184.146329884 xi-gamma-Undecalactone C11H20O2 PHXATPHONSXBIL-UHFFFAOYSA-N -HMDB0038604 208.109944378 "Amyl salicylate" C12H16O3 RANVDUNFZBMTBK-UHFFFAOYSA-N -HMDB0039229 257.101170605 Pyro-L-glutaminyl-L-glutamine C10H15N3O5 ILAITOFTZJRIFJ-WDSKDSINSA-N -HMDB0039618 130.099379692 "Propyl butyrate" C7H14O2 HUAZGNHGCJGYNP-UHFFFAOYSA-N -HMDB0040209 144.115029756 "Ethyl hexanoate" C8H16O2 SHZIWNPUGXLXDT-UHFFFAOYSA-N -HMDB0040240 154.081621138 2-Pentylthiophene C9H14S NOYVOSGVFSEKPR-UHFFFAOYSA-N -HMDB0040272 124.088815006 2-Butylfuran C8H12O NWZIYQNUCXUJJJ-UHFFFAOYSA-N -HMDB0040392 270.255880332 "Isopropyl tetradecanoate" C17H34O2 AXISYYRBXTVTFY-UHFFFAOYSA-N -HMDB0040966 110.109550448 1,3-Octadiene C8H14 QTYUSOHYEPOHLV-FNORWQNLSA-N -HMDB0041288 186.198365454 2-Butyl-1-octanol C12H26O XMVBHZBLHNOQON-UHFFFAOYSA-N -HMDB0041576 204.187800773 beta-Cadinene C15H24 USDOQCCMRDNVAH-UHFFFAOYSA-N -HMDB0041607 138.068079562 2-Phenoxyethanol C8H10O2 QCDWFXQBSFUVSP-UHFFFAOYSA-N -HMDB0041822 56.02621475 Acrolein C3H4O HGINCPLSRVDWNT-UHFFFAOYSA-N -HMDB0041980 163.875410828 Perchloroethylene C2Cl4 CYTYCFOTNPOANT-UHFFFAOYSA-N -HMDB0059655 148.037173366 2-Hydroxyglutarate C5H8O5 HWXBTNAVRSUOJR-UHFFFAOYSA-N -HMDB0059698 198.140850576 Cadalene C15H18 VMOJIHDTVZTGDO-UHFFFAOYSA-N -HMDB0059819 120.093900384 o-Ethyltoluene C9H12 HYFLWBNQFMXCPA-UHFFFAOYSA-N -HMDB0059820 242.224580204 Isopropyl_laurate C15H30O2 UJPPXNXOEVDSRW-UHFFFAOYSA-N -HMDB0059829 200.15650064 "Isolongifolene, 4,5,9,10-dehydro-" C15H20 MOLSSUUBCUMURN-UHFFFAOYSA-N -HMDB0059830 240.281701152 Heptadecane C17H36 NDJKXXJCMXVBJW-UHFFFAOYSA-N -HMDB0059835 142.135765198 Nonanal C9H18O GYHFUZHODSMOHU-UHFFFAOYSA-N -HMDB0059839 136.125200515 Camphene C10H16 CRPUJAZIXJMDBK-UHFFFAOYSA-N -HMDB0059843 88.034670946 (1E)-1-(methylthio)prop-1-ene C4H8S YJOGCMRDEUBRJD-ONEGZZNKSA-N -HMDB0059851 106.07825032 o-Xylene C8H10 CTQNGGLPUBDAKN-UHFFFAOYSA-N -HMDB0059864 154.135765198 Isomenthone C10H18O NFLGAXVYCFJBMK-UHFFFAOYSA-N -HMDB0059874 168.187800768 1-Dodecene C12H24 CRSBERNSMYQZNG-UHFFFAOYSA-N -HMDB0059883 192.151415262 alpha-Ionone C13H20O UZFLPKAIBPNNCA-BQYQJAHWSA-N -HMDB0059886 212.250401024 Pentadecane C15H32 YCOZIPAWZNQLMR-UHFFFAOYSA-N -HMDB0059897 146.073164942 "Benzofuran, 4,7-dimethyl-" C10H10O PFXVPEGRXODMIQ-UHFFFAOYSA-N -HMDB0059901 120.093900384 Hemimellitene C9H12 FYGHSUNMUKGBRK-UHFFFAOYSA-N -HMDB0059906 190.135765198 Megastigmatrienone C13H18O YKVWPZJHENXDAJ-VOTSOKGWSA-N -HMDB0059907 198.23475096 Tetradecane C14H30 BGHCVCJVXZWKCC-UHFFFAOYSA-N -HMDB0059909 282.328651344 Eicosane C20H42 CBFCDTFDPHXCNY-UHFFFAOYSA-N -HMDB0059924 106.07825032 p-Xylene C8H10 URLKBWYHVLBVBO-UHFFFAOYSA-N -HMDB0060179 153.009578407 3-Sulfinato-L-alaninate C3H7NO4S ADVPTQAUNPRNPO-REOHCLBHSA-N -HMDB0060180 185.99293909 (2R)-2-Hydroxy-3-(phosphonatooxy)propanoate C3H7O7P OSJPPGNTCRNQQC-UWTATZPHSA-N -HMDB0060256 166.047738052 L-Xylonate C5H10O6 QXKAIJAYHKCRRA-NUNKFHFFSA-N -HMDB0060260 167.020514982 "Urate radical" C5H3N4O3 RKXSGLUFSIPOGU-UHFFFAOYSA-N -HMDB0061385 287.951162589 Triclosan C12H7Cl3O2 XEFQLINVKFYRCS-UHFFFAOYSA-N -HMDB0061708 296.23514489 13-HODE C18H32O3 HNICUWMFWZBIFP-IRQZEAMPSA-N -HMDB0061717 261.121237336 Succinylcarnitine C11H19NO6 HAEVNYBCYZZDFL-MRVPVSSYSA-N -HMDB0061779 204.187800773 Isocaryophyllene C15H24 NPNUFJAVOOONJE-FLFDDASRSA-N -HMDB0061780 206.203450832 1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane C15H26 JGZYEZBCFOHEEC-UHFFFAOYSA-N -HMDB0061781 228.20893014 "10-Methyltridecanoic acid" C14H28O2 OVRJJCKGCSPVGT-UHFFFAOYSA-N -HMDB0061782 296.344301408 Heneicosane C21H44 FNAZRRHPUDJQCJ-UHFFFAOYSA-N -HMDB0061783 98.109550448 (E)-Hept-2-ene C7H14 OTTZHAVKAVGASB-HWKANZROSA-N -HMDB0061785 147.104799421 3-Methyl-3-phenylazetidine C10H13N YOLLUMURPUEOJW-UHFFFAOYSA-N -HMDB0061786 163.099714043 n-Propylbenzamide C10H13NO DYZWXBMTHNHXML-UHFFFAOYSA-N -HMDB0061787 134.109550448 (3E,5E)-2,6-Dimethyl-1,3,5,7-octatetraene C10H14 HPZWSJQQCJZBBG-LQPGMRSMSA-N -HMDB0061788 150.10446507 (S)-2-methyl-5-(1-Methylethenyl)-2-cyclohexen-1-one C10H14O ULDHMXUKGWMISQ-SECBINFHSA-N -HMDB0061789 136.125200512 2,6-Dimethyl-2,4,6-octatriene C10H16 GQVMHMFBVWSSPF-UHFFFAOYSA-N -HMDB0061790 136.125200515 "Santolina triene " C10H16 ZQGDEJAPCUGBRH-UHFFFAOYSA-N -HMDB0061791 136.125200512 2,7,7-Trimethyl-bicyclo[2.2.1]hept-2-ene C10H16 QWEFTWKQGYFNTF-UHFFFAOYSA-N -HMDB0061792 136.125200512 3-Methylene-1,5,5-trimethylcyclohexene C10H16 ZKXYHQFGFMZPPJ-UHFFFAOYSA-N -HMDB0061793 136.125200512 Isolimonene C10H16 TWCNAXRPQBLSNO-UWVGGRQHSA-N -HMDB0061795 138.140850576 (S)-3,7-Dimethyl-1,6-octadiene C10H18 FUDNBFMOXDUIIE-SNVBAGLBSA-N -HMDB0061796 138.14085058 cis-Carane C10H18 BWRHOYDPVJPXMF-UHFFFAOYSA-N -HMDB0061797 138.140850576 2-Menthene C10H18 WHNGPXQYYRWQAS-VHSXEESVSA-N -HMDB0061798 138.140850576 1-Methyl-3-(2-methyl-1-propenyl)cyclopentane C10H18 ZNVLSGKSXSJTNY-UHFFFAOYSA-N -HMDB0061799 138.140850576 1-Methyl-3-(2-methyl-2-propenyl)-cyclopentane C10H18 LRXVCZRWTBKTGT-UHFFFAOYSA-N -HMDB0061800 138.140850576 1-(3-Methylbutyl)-cyclopentene C10H18 LDBWEVZRYRUOOH-UHFFFAOYSA-N -HMDB0061801 138.140850576 3-(2-Methylpropyl)-cyclohexene C10H18 NVLNRIBMCIJLQD-UHFFFAOYSA-N -HMDB0061802 154.135765198 5-Methyl-2-(1-methylethyl)-cyclohexanone C10H18O NFLGAXVYCFJBMK-YGPZHTELSA-N -HMDB0061803 140.15650064 cis-3-Decene C10H20 GVRWIAHBVAYKIZ-ALCCZGGFSA-N -HMDB0061805 172.146329884 "(2S)-2-Ethylhexyl acetate" C10H20O2 WOYWLLHHWAMFCB-JTQLQIEISA-N -HMDB0061806 142.172150704 3,3,5-Trimethylheptane C10H22 VRVRZZWPKABUOE-UHFFFAOYSA-N -HMDB0061807 265.966812653 "alpha-Trichloromethylbenzyl acetate" C10H9Cl3O2 JKRWZLOCPLZZEI-UHFFFAOYSA-N -HMDB0061808 146.109550448 (3-Methyl-2-butenyl)-benzene C11H14 XGADZHWYGCKKJF-UHFFFAOYSA-N -HMDB0061809 148.125200512 1-Methyl-4-(1-methylpropyl)-benzene C11H16 LWCFXYMSEGQWNB-UHFFFAOYSA-N -HMDB0061810 148.125200512 2,4-Dimethyl-1-(1-methylethyl)-benzene C11H16 AADQFNAACHHRLT-UHFFFAOYSA-N -HMDB0061811 150.140850576 4-Methyl-2-methylene-1-(1methylethylidene)-cyclohexane C11H18 CDVJOIYHIIZJKX-UHFFFAOYSA-N -HMDB0061812 154.172150704 (E)-5-Undecene C11H22 NGCRXXLKJAAUQQ-PKNBQFBNSA-N -HMDB0061813 160.125200512 1-(1-Methylethenyl)-4-(1-methylethyl)benzene C12H16 XMCNZCCURGYSDQ-UHFFFAOYSA-N -HMDB0061814 160.125200512 1-(1-methylethenyl)-3-(1-methylethyl)-benzene C12H16 BDXXZCIRCYKRBT-UHFFFAOYSA-N -HMDB0061815 162.140850576 Hexylbenzene C12H18 LTEQMZWBSYACLV-UHFFFAOYSA-N -HMDB0061816 196.146329884 3,7-Dimethyl-2,6-octadien-1-ylacetate C12H20O2 HIGQPQRQIQDZMP-UHFFFAOYSA-N -HMDB0061817 166.172150704 1,1'-Ethylidenebis-cyclopentane C12H22 XWKIKXOZAGBKSO-UHFFFAOYSA-N -HMDB0061818 166.172150704 (E,Z)-2,4-Dodecadiene C12H22 NJMCFBIRFRIKSQ-PKWCJPJFSA-N -HMDB0061819 168.187800768 (E)-2-Dodecene C12H24 ADOQBZAVKYCFOI-HWKANZROSA-N -HMDB0061820 168.187800768 (Z)-3-Dodecene C12H24 WLTSXAIICPDFKI-ALCCZGGFSA-N -HMDB0061821 168.187800768 (E)-3-Dodecene C12H24 WLTSXAIICPDFKI-FNORWQNLSA-N -HMDB0061822 282.167853186 "Hexaethylene glycol" C12H26O7 IIRDTKBZINWQAW-UHFFFAOYSA-N -HMDB0061823 220.109944378 "3-Hexenyl salicylic acid" C13H16O3 IEPWIPZLLIOZLU-ONEGZZNKSA-N -HMDB0061824 174.140850576 1-Methyl-4-(1-methyl-2-propenyl)-benzene C13H18 IRICXAFZMINCTB-UHFFFAOYSA-N -HMDB0061825 176.15650064 1-Phenylheptane C13H20 LBNXAWYDQUGHGX-UHFFFAOYSA-N -HMDB0061826 176.15650064 1-Methyl-2-n-hexylbenzene C13H20 BNXNQXKAEVKUJG-UHFFFAOYSA-N -HMDB0061827 182.203450832 6-Tridecene C13H26 QHOMPCGOCNNMFK-QBFSEMIESA-N -HMDB0061828 214.193280076 "9-Methyldodecanoic acid" C13H26O2 NQWYEPPIHUGBHF-UHFFFAOYSA-N -HMDB0061829 214.193280076 "Isopropyl dodecanoic acid" C13H26O2 PKPPDYGHKDIKBH-UHFFFAOYSA-N -HMDB0061831 206.167065326 (Z)-alpha-Irone C14H22O JZQOJFLIJNRDHK-HWELFCKPSA-N -HMDB0061832 192.187800768 1-Acetyl-2-methylcyclopentene C14H24 PLHCNOGRIXPXHK-UHFFFAOYSA-N -HMDB0061833 196.219100896 (E)-7-Tetradecene C14H28 UBDIXSAEHLOROW-BUHFOSPRSA-N -HMDB0061834 196.219100896 1-Tetradecene C14H28 HFDVRLIODXPAHB-UHFFFAOYSA-N -HMDB0061835 326.194067936 "Heptaethylene glycol" C14H30O8 XPJRQAIZZQMSCM-UHFFFAOYSA-N -HMDB0061836 228.115029756 bis(Benzyloxy)methane C15H16O2 JCTHGPXQXLMSDK-UHFFFAOYSA-N -HMDB0061837 202.172150704 Calamenene C15H22 PGTJIOWQJWHTJJ-CHWSQXEVSA-N -HMDB0061838 202.172150704 (-)-alpha-Curcumene C15H22 VMYXUZSZMNBRCN-CQSZACIVSA-N -HMDB0061839 250.15689457 "Ethylhexyl salicylate" C15H22O3 FMRHJJZUHUTGKE-UHFFFAOYSA-N -HMDB0061840 204.187800768 beta-Clovene C15H24 NRJSJVYGFMVJAR-UHFFFAOYSA-N -HMDB0061841 204.187800768 trans-Muurola-4(14),5-diene C15H24 RNDFUOKDULDZPR-WLDKUNSKSA-N -HMDB0061843 204.187800768 "1R,3Z,9S-2,6,10,10 Tetramethylbicyclo[7.2.0]undeca-2,6-diene" C15H24 ULWLVRZSZQKPOE-HONFXZPPSA-N -HMDB0061845 204.187800768 Humulen-(v1) C15H24 NSMRKFBAPAOVQL-FLIBITNWSA-N -HMDB0061846 204.187800768 "1S,2S,5R-1,4,4 Trimethyltricyclo[6.3.1.0(2,5)]dodec-8(9)- ene" C15H24 LRDGPLGHXZSQGB-UHFFFAOYSA-N -HMDB0061847 192.187800768 1,2-Dimethyl-3,5-bis(1-methylethenyl)cyclohexane C14H24 PLHCNOGRIXPXHK-UHFFFAOYSA-N -HMDB0061848 204.187800768 beta-Elemene C15H24 OPFTUNCRGUEPRZ-QLFBSQMISA-N -HMDB0061849 204.187800768 (+)-Ledene C15H24 WGTRJVCFDUCKCM-FMKGYKFTSA-N -HMDB0061850 204.187800768 alpha-Bourbonene C15H24 FAIMMSRDTUMTQR-UHFFFAOYSA-N -HMDB0061851 204.187800773 alpha-Copaene C15H24 VLXDPFLIRFYIME-XIQJJJERSA-N -HMDB0061852 204.187800768 Ylangene C15H24 VLXDPFLIRFYIME-XTLGRWLVSA-N -HMDB0061853 204.187800768 beta-Cubebene C15H24 FSRZGYRCMPZNJF-KHMAMNHCSA-N -HMDB0061854 299.061613977 "8-Anilino-1-naphthalene sulfonate" C16H13NO3S FWEOQOXTVHGIFQ-UHFFFAOYSA-N -HMDB0061855 226.266051088 4-Methylpentadecane C16H34 ODDVOCXSLXTIIU-UHFFFAOYSA-N -HMDB0061856 242.26096571 1,1'-Oxybisoctane C16H34O NKJOXAZJBOMXID-UHFFFAOYSA-N -HMDB0061857 232.219100896 6-Phenylundecane C17H28 WCABIRIFXVXGQH-UHFFFAOYSA-N -HMDB0061859 270.255880332 "Methyl hexadecanoic acid" C17H34O2 FLIACVVOZYBSBS-UHFFFAOYSA-N -HMDB0061860 258.198365454 "2-Acetyl-3,5,5,6,8,8-hexamethyl-5,6,7,8- tetrahydronaphthalene" C18H26O DNRJTBAOUJJKDY-UHFFFAOYSA-N -HMDB0061861 290.188194698 "Octyl 4-methoxycinnamic acid" C18H26O3 YBGZDTIWKVFICR-JLHYYAGUSA-N -HMDB0061862 282.292265838 2-Nonadecanone C19H38O IEDKVDCIEARIIU-UHFFFAOYSA-N -HMDB0061863 268.31300128 3-Methyloctadecane C19H40 PGZRTPKNSFMAOP-UHFFFAOYSA-N -HMDB0061864 280.24023027 "Dihomolinoleic acid" C18H32O2 GKJZMAHZJGSBKD-JPDBVBESSA-N -HMDB0061865 310.359951472 Docosane C22H46 HOWGUJZVBDQJKV-UHFFFAOYSA-N -HMDB0061866 324.375601536 Tricosane C23H48 FIGVVZUWCLSUEI-UHFFFAOYSA-N -HMDB0061867 366.422551728 Hexacosane C26H54 HMSWAIKSFDFLKN-UHFFFAOYSA-N -HMDB0061868 394.453851856 Octacosane C28H58 ZYURHZPYMFLWSH-UHFFFAOYSA-N -HMDB0061869 41.026549101 Acetonitrile C2H3N WEVYAHXRMPXWCK-UHFFFAOYSA-N -HMDB0061871 90.05032101 1-(Methylthio)-propane C4H10S ZOASGOXWEHUTKZ-UHFFFAOYSA-N -HMDB0061872 99.014269855 Isothiocyanatocyclopropane C4H5NS JGFBQFKZKSSODQ-UHFFFAOYSA-N -HMDB0061873 70.041864814 3-Buten-2-one C4H6O FUSUHKVFWTUUBE-UHFFFAOYSA-N -HMDB0061874 70.041864814 Methacrolein C4H6O STNJBCKSHOAVAJ-UHFFFAOYSA-N -HMDB0061875 84.068748266 2-(Dimethylamino)acetonitrile C4H8N2 PLXBWEPPAAQASG-UHFFFAOYSA-N -HMDB0061876 88.034670946 (Z)-1-(Methylthio)-1-propene C4H8S YJOGCMRDEUBRJD-ARJAWSKDSA-N -HMDB0061877 119.058243159 4-Amino-3-hydroxybutyrate C4H9NO3 YQGDEPYYFWUPGO-UHFFFAOYSA-N -HMDB0061880 131.058243159 N-Acetyl-beta-alanine C5H9NO3 LJLLAWRMBZNPMO-UHFFFAOYSA-N -HMDB0061881 130.062994186 4-Acetylbutyrate C6H10O3 MGTZCLMLSSAXLD-UHFFFAOYSA-N -HMDB0061882 100.088815006 3-Methyl-1-penten-3-ol C6H12O HFYAEUXHCMTPOL-UHFFFAOYSA-N -HMDB0061884 86.109550448 2-Methylpentane C6H14 AFABGHUZZDYHJO-UHFFFAOYSA-N -HMDB0061885 86.109550448 3-Methylpentane C6H14 PFEOZHBOMNWTJB-UHFFFAOYSA-N -HMDB0061886 102.10446507 2-Hexanol C6H14O QNVRIHYSUZMSGM-UHFFFAOYSA-N -HMDB0061887 93.057849229 3-Methylpyridine C6H7N ITQTTZVARXURQS-UHFFFAOYSA-N -HMDB0061888 93.057849229 2-Methylpyridine C6H7N BSKHPKMHTQYZBB-UHFFFAOYSA-N -HMDB0061890 186.064056818 Pyroglutamylglycine C7H10N2O4 MGEFGYONNZYSPY-UHFFFAOYSA-N -HMDB0061892 98.109550448 2-Heptene C7H14 OTTZHAVKAVGASB-HYXAFXHYSA-N -HMDB0061893 98.109550448 (E)-Hept-3-ene C7H14 WZHKDGJSXCTSCK-FNORWQNLSA-N -HMDB0061894 98.109550448 (E)-4,4-Dimethyl-2-pentene C7H14 BIDIHFPLDRSAMB-AATRIKPKSA-N -HMDB0061895 98.109550448 2,4-Dimethyl-2-pentene C7H14 VVCFYASOGFVJFN-UHFFFAOYSA-N -HMDB0061896 114.10446507 2-Methyl-3-hexanone C7H14O HIGGFWFRAWSMBR-UHFFFAOYSA-N -HMDB0061897 108.093900384 (Z)-1,3-Octadiene C8H12 RRKODOZNUZCUBN-HSFFGMMNSA-N -HMDB0061898 124.088815006 Methyl-1-cyclopenten-1-yl)-ethanone C8H12O HDURLXYBKGWETC-UHFFFAOYSA-N -HMDB0061899 110.109550448 2-(Methylenebutyl)-cyclopropane C8H14 VDKZAQZRSGYRSL-POYBYMJQSA-N -HMDB0061900 110.109550448 2,4-Octadiene C8H14 NZLCAHVLJPDRBL-VSAQMIDASA-N -HMDB0061902 110.109550448 2,5-Dimethyl-2,4-hexadiene C8H14 DZPCYXCBXGQBRN-UHFFFAOYSA-N -HMDB0061903 112.125200512 (Z)-2-Octene C8H16 ILPBINAXDRFYPL-HYXAFXHYSA-N -HMDB0061904 112.125200512 (E)-2-Octene C8H16 ILPBINAXDRFYPL-UHFFFAOYSA-N -HMDB0061905 112.125200512 (Z)-3-Octene C8H16 YCTDZYMMFQCTEO-ALCCZGGFSA-N -HMDB0061906 112.125200512 (E)-3-Octene C8H16 YCTDZYMMFQCTEO-FNORWQNLSA-N -HMDB0061907 112.125200512 3-Methyleneheptane C8H16 XTVRLCUJHGUXCP-UHFFFAOYSA-N -HMDB0061908 112.125200512 3-Methyl-1-heptene C8H16 QDMFTFWKTYXBIW-UHFFFAOYSA-N -HMDB0061909 112.125200512 3-Methyl-3-heptene C8H16 AAUHUDBDDBJONC-BQYQJAHWSA-N -HMDB0061910 112.125200512 (E)-4-Methyl-2-heptene C8H16 SVGLFIBXFVQUQY-GQCTYLIASA-N -HMDB0061911 112.125200512 4-Methyl-3-heptene C8H16 KKVVJQGDNYIIMN-SOFGYWHQSA-N -HMDB0061912 128.120115134 3,4-Dimethylcyclohexanol C8H16O ZBAXJUPCYVIBSP-UHFFFAOYSA-N -HMDB0061913 128.120115134 3,5-Dimethylcyclohexanol C8H16O WIYNOPYNRFPWNB-UHFFFAOYSA-N -HMDB0061915 114.140850576 2-Methylheptane C8H18 JVSWJIKNEAIKJW-UHFFFAOYSA-N -HMDB0061918 133.052763851 1,3-Dihydro-(2H)-indol-2-one C8H7NO JYGFTBXVXVMTGB-UHFFFAOYSA-N -HMDB0061919 151.063328537 2'-Hydroxyacetanilide C8H9NO2 ADVGKWPZRIDURE-UHFFFAOYSA-N -HMDB0061920 124.125200512 Prop-2-enylcyclohexane C9H16 KVOZXXSUSRZIKD-UHFFFAOYSA-N -HMDB0061921 92.903634644 Niobium Nb QUWPZPLTANKXAM-UHFFFAOYSA-N -HMDB0061922 180.063388116 Alpha-D-Glucopyranoside C6H12O6 WQZGKKKJIJFFOK-GKFJPSPNSA-N -HMDB0061923 190.172150704 1,3-Di-tert-butylbenzene C14H22 ILNDSSCEZZFNGE-UHFFFAOYSA-N -HMDB0061924 198.23475096 2,3,5,8-Tetramethyldecane C14H30 XTIADNINQBIUNR-UHFFFAOYSA-N -HMDB0061925 300.20893014 "Dehydroabietic acid" C20H28O2 NFWKVWVWBFBAOV-IPNZSQQUSA-N -HMDB0061926 393.339550381 P,P-Dioctyldiphenylamine C28H43N QAPVYZRWKDXNDK-UHFFFAOYSA-N -HMDB0061927 118.062994186 "5-Hydroxypentanoic acid" C5H10O3 PHOJOSOUIAQEDH-UHFFFAOYSA-N -HMDB0061928 140.044899461 "Trifluoromethyl-bismethyl ketone" C5H7F3O NLCCAFQWEKMQLM-UHFFFAOYSA-N -HMDB0061929 114.068079564 Dihydro-4,4-dimethyl-2(3H)-furanone C6H10O2 LZAKUZBAAQDJCF-UHFFFAOYSA-N -HMDB0061930 146.057908808 "4-Ethoxy-4-oxobutanoic acid" C6H10O4 LOLKAJARZKDJTD-UHFFFAOYSA-N -HMDB0061931 144.115029756 Tetrahydro-2,5-dimethyl-2H-pyranmethanol C8H16O2 BJQJGDGEKXRYBA-UHFFFAOYSA-N -HMDB0061932 171.107940704 Valero-1,5-lactam C8H17NOSi PMQNJTKTWDVUNY-UHFFFAOYSA-N -HMDB0061933 147.032028409 1H-Indole-2,3-dione C8H5NO2 JXDYKVIHCLTXOP-UHFFFAOYSA-N -HMDB0061934 92.970690481 "Thiocarbamic acid" CH3NS2 DKVNPHBNOWQYFE-UHFFFAOYSA-N -HMDB0061935 264.172544634 "3,5-Bis(1,1-dimethylethyl)-4-hydroxy-benzoic acid ethyl ester" C16H24O3 UPVYFJALDJUSOV-UHFFFAOYSA-N -HMDB0061936 174.161979948 Isooctanedioldibutyrate C10H22O2 WMEDSSFYIKNTNG-UHFFFAOYSA-N -HMDB0061938 136.125200512 Isoterpinolene C10H16 CIPXOBMYVWRNLL-UHFFFAOYSA-N -HMDB0061939 179.043855423 Methyl-N,N-diethylthiocarbamate C6H13NOS2 VQRMNXBTDRJEKI-UHFFFAOYSA-N -HMDB0061942 220.109944378 "cis-3-Hexenyl salicylate" C13H16O3 IEPWIPZLLIOZLU-ARJAWSKDSA-N -HMDB0061943 222.125594442 "Hexyl salicylic acid" C13H18O3 DUKPKQFHJQGTGU-UHFFFAOYSA-N -HMDB0061944 106.062994186 Trihydroxybutane C4H10O3 GTTSNKDQDACYLV-UHFFFAOYSA-N -HMDB0061945 126.10446507 2-Ethyl-2-hexenal C8H14O PYLMCYQHBRSDND-SOFGYWHQSA-N -HMDB0061946 284.271530396 "Hexyl dodecanoate" C18H36O2 CMBYOWLFQAFZCP-UHFFFAOYSA-N -HMDB0062403 197.032422339 4-hydroxy-3-nitrophenylacetate C8H7NO5 QBHBHOSRLDPIHG-UHFFFAOYSA-N
--- a/test-data/out04.tabular Tue Jan 21 16:09:45 2020 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,2356 +0,0 @@ -HMDB_ID MzBank MetName ChemFormula INChIkey -BMDB00001 169.085126611 1-Methylhistidine C7H11N3O2 BRMWTNUJHUMWMS-LURJTMIESA-N -BMDB00008 104.047344122 "2-Hydroxybutyric acid" C4H8O3 AFENDNXGAFYKQO-UHFFFAOYSA-N -BMDB00014 227.090605919 Deoxycytidine C9H13N3O4 CKTSBUTUHBMZGZ-SHYZEUOFSA-N -BMDB00020 152.047344122 "p-Hydroxyphenylacetic acid" C8H8O3 XQXPVVBIMDBYFF-UHFFFAOYSA-N -BMDB00030 244.088163078 Biotin C10H16N2O3S YBJHBAHKTGYVGT-ZKWXMUAHSA-N -BMDB00033 226.106590334 Carnosine C9H14N4O3 CQOVPNPJLQNMDC-ZETCQYMHSA-N -BMDB00034 135.054495185 Adenine C5H5N5 GFFGJBXGBJISGV-UHFFFAOYSA-N -BMDB00037 360.193674006 Aldosterone C21H28O5 PQSUYGKTWSAVDQ-SRPWZAMTSA-N -BMDB00039 88.0524295 "Butyric acid" C4H8O2 FERIUCNNQQJTOY-UHFFFAOYSA-N -BMDB00042 60.021129372 "Acetic acid" C2H4O2 QTBSBXVTEAMEQO-UHFFFAOYSA-N -BMDB00043 117.078978601 Betaine C5H11NO2 KWIUHFFTVRNATP-UHFFFAOYSA-N -BMDB00044 176.032087988 "Ascorbic acid" C6H8O6 TYQCGQRIZGCHNB-MVHIGOERSA-N -BMDB00045 347.063084339 "Adenosine monophosphate" C10H14N5O7P UDMBCSSLTHHNCD-KQYNXXCUSA-N -BMDB00050 267.096753929 Adenosine C10H13N5O4 OIRDTQYFTABQOQ-KQYNXXCUSA-N -BMDB00053 286.193280076 Androstenedione C19H26O2 AEMFNILZOJDQLW-QAGGRKNESA-N -BMDB00058 329.052519653 "Cyclic AMP" C10H12N5O6P IVOMOUWHDPKRLL-KQYNXXCUSA-N -BMDB00060 102.031694058 "Acetoacetic acid" C4H6O3 WDJHALXBUFZDSR-UHFFFAOYSA-N -BMDB00062 161.105193351 L-Carnitine C7H15NO3 PHIQHXFUZVPYII-LURJTMIESA-N -BMDB00064 131.069476547 Creatine C4H9N3O2 CVSVTCORWBXHQV-UHFFFAOYSA-N -BMDB00067 386.354866094 Cholesterol C27H46O HVYWMOMLDIMFJA-FNOPAARDSA-N -BMDB00070 129.078978601 "Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-UHFFFAOYSA-N -BMDB00072 174.016437924 "cis-Aconitic acid" C6H6O6 GTZCVFVGUGFEME-IWQZZHSRSA-N -BMDB00073 153.078978601 Dopamine C8H11NO2 VYFYYTLLBUKUHU-UHFFFAOYSA-N -BMDB00076 114.042927446 Dihydrouracil C4H6N2O2 OIVLITBTBDPEFK-UHFFFAOYSA-N -BMDB00077 288.20893014 Dehydroepiandrosterone C19H28O2 FMGSKLZLMKYGDP-INNQQZFDSA-N -BMDB00079 128.05857751 Dihydrothymine C5H8N2O2 NBAKTGXDIBVZOO-UHFFFAOYSA-N -BMDB00086 257.102823889 Glycerophosphocholine C8H20NO6P SUHOQUVVVLNYQR-QMMMGPOBSA-N -BMDB00087 45.057849229 Dimethylamine C2H7N ROSDSFDQCJNGOL-UHFFFAOYSA-N -BMDB00089 243.085520541 Cytidine C9H13N3O5 UHDGCWIWMRVCDJ-XVFCMESISA-N -BMDB00092 103.063328537 Dimethylglycine C4H9NO2 FFDGPVCHZBVARC-UHFFFAOYSA-N -BMDB00094 192.02700261 "Citric acid" C6H8O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N -BMDB00095 323.051850951 "Cytidine monophosphate" C9H14N3O8P IERHLVCPSMICTF-XVFCMESISA-N -BMDB00097 104.107539075 Choline C5H14NO OEYIOHPDSNJKLS-UHFFFAOYSA-N -BMDB00099 222.067427636 L-Cystathionine C7H14N2O4S ILRYLPWNYFXEMH-WHFBIAKZSA-N -BMDB00101 251.101839307 Deoxyadenosine C10H13N5O3 OLXZPDWKRNYJJZ-RRKCRQDMSA-N -BMDB00107 182.07903818 Galactitol C6H14O6 FBPFZTCFMRRESA-GUCUJZIJSA-N -BMDB00108 46.041864814 Ethanol C2H6O LFQSCWFLJHTTHZ-UHFFFAOYSA-N -BMDB00112 103.063328537 "Gamma-Aminobutyric acid" C4H9NO2 BTCSSZJGUNDROE-UHFFFAOYSA-N -BMDB00118 182.057908808 "Homovanillic acid" C9H10O4 QRMZSPFSDQBLIX-UHFFFAOYSA-N -BMDB00121 441.139681375 "Folic acid" C19H19N7O6 OVBPIULPVIDEAO-LBPRGKRZSA-N -BMDB00122 180.063388116 D-Glucose C6H12O6 WQZGKKKJIJFFOK-GASJEMHNSA-N -BMDB00123 75.032028409 Glycine C2H5NO2 DHMQDGOQFOQNFH-UHFFFAOYSA-N -BMDB00124 260.029718526 "Fructose 6-phosphate" C6H13O9P GSXOAOHZAIYLCY-HSUXUTPPSA-N -BMDB00126 172.013674532 "Glycerol 3-phosphate" C3H9O6P AWUCVROLDVIAJX-GSVOUGTGSA-N -BMDB00127 194.042652674 "D-Glucuronic acid" C6H10O7 AEMOLEFTQBMNLQ-WAXACMCWSA-N -BMDB00130 168.042258744 "Homogentisic acid" C8H8O4 IGMNYECMUMZDDF-UHFFFAOYSA-N -BMDB00131 92.047344122 Glycerol C3H8O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N -BMDB00132 151.049409807 Guanine C5H5N5O UYTPUPDQBNUYGX-UHFFFAOYSA-N -BMDB00133 283.091668551 Guanosine C10H13N5O5 NYHBQMYGNKIUIF-UUOKFMHZSA-N -BMDB00134 116.010958616 "Fumaric acid" C4H4O4 VZCYOOQTPOCHFL-OWOJBTEDSA-N -BMDB00138 465.309038113 "Glycocholic acid" C26H43NO6 RFDAIACWWDREDC-MZMBZMQMSA-N -BMDB00139 106.02660868 "Glyceric acid" C3H6O4 RBNPOMFGQQGHHO-UWTATZPHSA-N -BMDB00142 46.005479308 "Formic acid" CH2O2 BDAGIHXWWSANSR-UHFFFAOYSA-N -BMDB00143 180.063388116 D-Galactose C6H12O6 WQZGKKKJIJFFOK-PHYPRBDBSA-N -BMDB00145 270.161979948 Estrone C18H22O2 DNXHEGUUPJUMQT-CBZIJGRNSA-N -BMDB00148 147.053157781 "L-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-VKHMYHEASA-N -BMDB00149 61.052763851 Ethanolamine C2H7NO HZAXFHJVJLSVMW-UHFFFAOYSA-N -BMDB00151 272.177630012 Estradiol C18H24O2 VOXZDWNPVJITMN-ZBRFXRBCSA-N -BMDB00153 288.172544634 Estriol C18H24O3 PROQIPRRNZUXQM-ZXXIGWHRSA-N -BMDB00156 134.021523302 "L-Malic acid" C4H6O5 BJEPYKJPYRNKOW-REOHCLBHSA-N -BMDB00157 136.03851077 Hypoxanthine C5H4N4O FDGQSTZJBFJUBT-UHFFFAOYSA-N -BMDB00158 181.073893223 L-Tyrosine C9H11NO3 OUYCCCASQSFEME-QMMMGPOBSA-N -BMDB00159 165.078978601 L-Phenylalanine C9H11NO2 COLNVLDHVKWLRT-QMMMGPOBSA-N -BMDB00161 89.047678473 L-Alanine C3H7NO2 QNAYBMKLOCPYGJ-REOHCLBHSA-N -BMDB00162 115.063328537 L-Proline C5H9NO2 ONIBWKKTOPOVIA-BYPYZUCNSA-N -BMDB00163 342.116211546 D-Maltose C12H22O11 GUBGYTABKSRVRQ-DKBJLJRDSA-N -BMDB00164 31.042199165 Methylamine CH5N BAVYZALUXZFZLV-UHFFFAOYSA-N -BMDB00167 119.058243159 L-Threonine C4H9NO3 AYFVYJQAPQTCCC-GBXIJSLDSA-N -BMDB00168 132.053492132 L-Asparagine C4H8N2O3 DCXYFEDJOCDNAF-REOHCLBHSA-N -BMDB00169 180.063388116 D-Mannose C6H12O6 WQZGKKKJIJFFOK-QTVWNMPRSA-N -BMDB00172 131.094628665 L-Isoleucine C6H13NO2 AGPKZVBTJJNPAG-WHFBIAKZSA-N -BMDB00174 164.068473494 L-Fucose C6H12O5 SHZGCJCMOBCMKK-DHVFOXMCSA-N -BMDB00175 348.047099924 "Inosinic acid" C10H13N4O8P GRSZFWQUAKGDAV-KQYNXXCUSA-N -BMDB00177 155.069476547 L-Histidine C6H9N3O2 HNDVDQJCIGZPNO-YFKPBYRVSA-N -BMDB00182 146.105527702 L-Lysine C6H14N2O2 KDXKERNSBIXSRK-YFKPBYRVSA-N -BMDB00186 342.116211546 Alpha-Lactose C12H22O11 GUBGYTABKSRVRQ-XLOQQCSPSA-N -BMDB00187 105.042593095 L-Serine C3H7NO3 MTCFGRXMJLQNBG-REOHCLBHSA-N -BMDB00190 90.031694058 "L-Lactic acid" C3H6O3 JVTAAEKCZFNVCJ-REOHCLBHSA-N -BMDB00191 133.037507717 "L-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-REOHCLBHSA-N -BMDB00192 240.023848262 L-Cystine C6H12N2O4S2 LEVWYRKDKASIDU-IMJSIDKUSA-N -BMDB00193 192.02700261 "Isocitric acid" C6H8O7 ODBLHEXUDAPZAU-UHFFFAOYSA-N -BMDB00195 268.080769514 Inosine C10H12N4O5 UGQMRVRMYYASKQ-KQYNXXCUSA-N -BMDB00201 203.115758037 L-Acetylcarnitine C9H17NO4 RDHQFKQIGNGIED-UHFFFAOYSA-N -BMDB00202 118.02660868 "Methylmalonic acid" C4H6O4 ZIYVHBGGAOATLY-UHFFFAOYSA-N -BMDB00206 188.116092388 N6-Acetyl-L-lysine C8H16N2O3 DTERQYGMUDWYAZ-ZETCQYMHSA-N -BMDB00207 282.255880332 "Oleic acid" C18H34O2 ZQPPMHVWECSIRJ-KTKRTIGZSA-N -BMDB00208 146.021523302 "Oxoglutaric acid" C5H6O5 KPGXRSRHYNQIFN-UHFFFAOYSA-N -BMDB00209 136.0524295 "Phenylacetic acid" C8H8O2 WLJVXDMOQOGPHL-UHFFFAOYSA-N -BMDB00210 219.110672659 "Pantothenic acid" C9H17NO5 GHOKWGTUZJEAQD-UHFFFAOYSA-N -BMDB00211 180.063388116 Myoinositol C6H12O6 CDAISMWEOUEBRE-GPIVLXJGSA-N -BMDB00212 221.089937217 N-Acetylgalactosamine C8H15NO6 OVRNDRQMDRJTHS-CBQIKETKSA-N -BMDB00213 260.029718526 "Myo-inositol 1-phosphate" C6H13O9P INAPMGSXUVUWAF-PTQMNWPWSA-N -BMDB00214 132.089877638 Ornithine C5H12N2O2 AHLPHDHHMVZTML-BYPYZUCNSA-N -BMDB00215 221.089937217 N-Acetyl-D-glucosamine C8H15NO6 OVRNDRQMDRJTHS-DMHSOCPYSA-N -BMDB00216 169.073893223 Norepinephrine C8H11NO3 SFLSHLFXELFNJZ-QMMMGPOBSA-N -BMDB00220 256.240230268 "Palmitic acid" C16H32O2 IPCSVZSSVZVIGE-UHFFFAOYSA-N -BMDB00223 132.005873238 "Oxalacetic acid" C4H4O5 KHPXUQMNIQBQEV-UHFFFAOYSA-N -BMDB00224 141.019094261 O-Phosphoethanolamine C2H8NO4P SUHOOTKUPISOBE-UHFFFAOYSA-N -BMDB00226 156.017106626 "Orotic acid" C5H4N2O4 PXQPEWDEAKTCGB-UHFFFAOYSA-N -BMDB00227 148.073558872 "Mevalonic acid" C6H12O4 KJTLQQUUPVSXIM-UHFFFAOYSA-N -BMDB00230 309.105981211 "N-Acetylneuraminic acid" C11H19NO9 SQVRNKJHWKZAKO-PFQGKNLYSA-N -BMDB00234 288.20893014 Testosterone C19H28O2 MUMGGOZAMZWBJJ-DYKIIFRCSA-N -BMDB00235 265.112306876 Thiamine C12H17N4OS JZRWCGZRTZMZEH-UHFFFAOYSA-N -BMDB00237 74.036779436 "Propionic acid" C3H6O2 XBDQKXXYIPTUBI-UHFFFAOYSA-N -BMDB00239 169.073893223 Pyridoxine C8H11NO3 LXNHXLLTXMVWPM-UHFFFAOYSA-N -BMDB00243 88.016043994 "Pyruvic acid" C3H4O3 LCTONWCANYUPML-UHFFFAOYSA-N -BMDB00244 376.138284392 Riboflavin C17H20N4O6 AUNGANRZJHBGPY-SCRDCRAPSA-N -BMDB00246 72.057514878 Tetrahydrofuran C4H8O WYURNTSHIVDZCO-UHFFFAOYSA-N -BMDB00251 125.014663785 Taurine C2H7NO3S XOAAWQZATWQOTB-UHFFFAOYSA-N -BMDB00252 299.282429433 Sphingosine C18H37NO2 WWUZIQQURGPMPG-CCEZHUSRSA-N -BMDB00254 118.02660868 "Succinic acid" C4H6O4 KDYFGRWQOYBRFD-UHFFFAOYSA-N -BMDB00258 342.116211546 Sucrose C12H22O11 CZMRCDWAGMRECN-UGDNZRGBSA-N -BMDB00262 126.042927446 Thymine C5H6N2O2 RWQNBRDOKXIBIV-UHFFFAOYSA-N -BMDB00263 167.982374404 "Phosphoenolpyruvic acid" C3H5O6P DTBNBXWJWCWCIK-UHFFFAOYSA-N -BMDB00265 650.790038137 Liothyronine C15H12I3NO4 AUYYCJSJGJYCDS-LBPRGKRZSA-N -BMDB00267 129.042593095 "Pyroglutamic acid" C5H7NO3 ODHCTXKNWHHXJC-VKHMYHEASA-N -BMDB00271 89.047678473 Sarcosine C3H7NO2 FSYKKLYZXJSNPZ-UHFFFAOYSA-N -BMDB00273 242.090271568 Thymidine C10H14N2O5 IQFYYKKMVGJFEH-XLPZGREQSA-N -BMDB00283 150.05282343 D-Ribose C5H10O5 HMFHBZSHGGEWLO-SOOFDHNKSA-N -BMDB00288 324.035866536 "Uridine 5'-monophosphate" C9H13N2O9P DJJCXFVJDGTHFX-XVFCMESISA-N -BMDB00289 168.028340014 "Uric acid" C5H4N4O3 LEHOTFFKMJEONL-UHFFFAOYSA-N -BMDB00292 152.033425392 Xanthine C5H4N4O2 LRFVTYWOQMYALW-UHFFFAOYSA-N -BMDB00294 60.03236276 Urea CH4N2O XSQUKJJJFZCRTK-UHFFFAOYSA-N -BMDB00296 244.069536126 Uridine C9H12N2O6 DRTQHJPVMGBUCF-XVFCMESISA-N -BMDB00300 112.027277382 Uracil C4H4N2O2 ISAKRJDGNUQOIC-UHFFFAOYSA-N -BMDB00305 286.229665582 "Vitamin A" C20H30O FPIPGXGPPPQFEQ-OVSJKPMPSA-N -BMDB00306 137.084063979 Tyramine C8H11NO DZGWFCGJZKJUFP-UHFFFAOYSA-N -BMDB00307 424.282489012 "1b-Hydroxycholic acid" C24H40O6 UYVVLXVBEQAATF-WAIVXGPNSA-N -BMDB00316 424.282489012 "2b,3a,7a,12a-Tetrahydroxy-5b-cholanoic acid" C24H40O6 IMMADCCLTPCOKH-DLPNMVJGSA-N -BMDB00341 172.073558872 "2-Octenedioic acid" C8H12O4 BNTPVRGYUHJFHN-HWKANZROSA-N -BMDB00357 104.047344122 "3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-UHFFFAOYSA-N -BMDB00362 185.99293909 "2-Phosphoglyceric acid" C3H7O7P GXIURPTVHJPJLF-UHFFFAOYSA-N -BMDB00378 245.162708229 2-Methylbutyroylcarnitine C12H23NO4 IHCPDBBYTYJYIL-UHFFFAOYSA-N -BMDB00379 206.042652674 "2-Methylcitric acid" C7H10O7 YNOXCRMFGMSKIJ-UHFFFAOYSA-N -BMDB00397 154.026608673 "2-Pyrocatechuic acid" C7H6O4 GLDQAMYCGOIJDV-UHFFFAOYSA-N -BMDB00429 272.177630012 17a-Estradiol C18H24O2 VOXZDWNPVJITMN-SFFUCWETSA-N -BMDB00430 416.329045274 "24,25-Dihydroxyvitamin D" C27H44O3 FCKJYANJHNLEEP-OIMXRAFZSA-N -BMDB00440 152.047344122 "3-Hydroxyphenylacetic acid" C8H8O3 FVMDYYGIDFPZAX-UHFFFAOYSA-N -BMDB00446 188.116092388 N-Alpha-ccetyllysine C8H16N2O3 VEYYWZRYIYDQJM-UHFFFAOYSA-N -BMDB00450 162.100442324 5-Hydroxylysine C6H14N2O3 YSMODUONRAFBET-UHNVWZDZSA-N -BMDB00452 103.063328537 "L-Alpha-aminobutyric acid" C4H9NO2 QWCKQJZIFLGMSD-VKHMYHEASA-N -BMDB00455 222.067427636 Allocystathionine C7H14N2O4S ILRYLPWNYFXEMH-ROLXFIACSA-N -BMDB00462 158.043990078 Allantoin C4H6N4O3 POJWUDADGALRAB-UHFFFAOYSA-N -BMDB00464 39.962591155 Calcium Ca BHPQYMZQTOCNFJ-UHFFFAOYSA-N -BMDB00469 142.037842068 5-Hydroxymethyluracil C5H6N2O3 JDBGXEHEIRGOBU-UHFFFAOYSA-N -BMDB00472 220.08479226 5-Hydroxy-L-tryptophan C11H12N2O3 LDCYZAJDBXYCGN-UHFFFAOYSA-N -BMDB00474 72.057514878 Butanone C4H8O ZWEHNKRNPOVVGH-UHFFFAOYSA-N -BMDB00479 169.085126611 3-Methylhistidine C7H11N3O2 JDHILDINMRGULE-LURJTMIESA-N -BMDB00482 144.115029756 "Caprylic acid" C8H16O2 WWZKQHOCKIZLMA-UHFFFAOYSA-N -BMDB00492 34.968852707 Chlorine Cl VEXZGXHMUGYJMC-UHFFFAOYSA-M -BMDB00499 226.193280076 "5-Tetradecenoic acid" C14H26O2 AFGUVBVUFZMJMX-MDZDMXLPSA-N -BMDB00500 138.031694053 "4-Hydroxybenzoic acid" C7H6O3 FJKROLUGYXJWQN-UHFFFAOYSA-N -BMDB00510 161.068807845 "Aminoadipic acid" C6H11NO4 OYIFNHCXNCRBQI-UHFFFAOYSA-N -BMDB00511 172.146329884 "Capric acid" C10H20O2 GHVNFZFCNZKVNT-UHFFFAOYSA-N -BMDB00517 174.111675712 L-Arginine C6H14N4O2 ODKSFYDXXFIFQN-BYPYZUCNSA-N -BMDB00528 158.03275669 "4,5-Dihydroorotic acid" C5H6N2O4 UFIVEPVSAGBUSI-UHFFFAOYSA-N -BMDB00529 198.161979948 "5-Dodecenoic acid" C12H22O2 IJBFSOLHRKELLR-BQYQJAHWSA-N -BMDB00535 116.083729628 "Caproic acid" C6H12O2 FUZZWVXGSFPDMH-UHFFFAOYSA-N -BMDB00538 506.995745159 "Adenosine triphosphate" C10H16N5O13P3 ZKHQWZAMYRWXGA-KQYNXXCUSA-N -BMDB00547 23.985041898 Magnesium Mg JLVVSXFLKOJNIY-UHFFFAOYSA-N -BMDB00548 554.454639716 TG(10:0/10:0/10:0)[iso] C33H62O6 LADGBHLMCUINGV-UHFFFAOYSA-N -BMDB00557 131.094628665 L-Alloisoleucine C6H13NO2 AGPKZVBTJJNPAG-UHNVWZDZSA-N -BMDB00561 536.438201803 B-Carotene C40H56 OENHQHLEOONYIE-JLTXGRSLSA-N -BMDB00562 113.058911861 Creatinine C4H7N3O DDRJAANPRJIHGJ-UHFFFAOYSA-N -BMDB00564 733.562155053 PC(16:0/16:0) C40H80NO8P KILNVBDSWZSGLL-KXQOOQHDSA-N -BMDB00568 152.068473494 D-Arabitol C5H12O5 HEBKCHPVOIAQTA-UHFFFAOYSA-N -BMDB00573 282.255880332 "Elaidic acid" C18H34O2 ZQPPMHVWECSIRJ-MDZDMXLPSA-N -BMDB00574 121.019749163 L-Cysteine C3H7NO2S XUJNEKJLAYXESH-REOHCLBHSA-N -BMDB00586 38.963706861 Potassium K NPYPAHLBTDXSSS-UHFFFAOYSA-N -BMDB00588 22.989769675 Sodium Na FKNQFGJONOIPTF-UHFFFAOYSA-N -BMDB00593 785.593455181 "PC(18:1(9Z)/18:1(9Z)) " C44H84NO8P SNKAWJBJQDLSFF-YEUCEMRASA-N -BMDB00598 31.97207069 Sulfide S UCKMPCXJQFINFW-UHFFFAOYSA-N -BMDB00599 51.940511904 Chromium Cr BFGKITSFLPAWGI-UHFFFAOYSA-N -BMDB00606 148.037173366 "D-2-Hydroxyglutaric acid" C5H8O5 HWXBTNAVRSUOJR-GSVOUGTGSA-N -BMDB00607 1354.5674 Cyanocobalamin C63H88CoN14O14P RMRCNWBMXRMIRW-JHUHWLDHSA-L -BMDB00608 58.933200194 Cobalt Co XLJKHNWPARRRJB-UHFFFAOYSA-N -BMDB00618 230.01915384 "D-Ribulose 5-phosphate" C5H11O8P KTVPXOYAKDPRHY-OWMBCFKOSA-N -BMDB00619 408.28757439 "Cholic acid" C24H40O5 BHQCQFFYRZLCQQ-IATNSQEUSA-N -BMDB00625 196.058302738 "Gluconic acid" C6H12O7 RGHNJXZEOKUKBD-SQOUGZDYSA-N -BMDB00628 288.20893014 Epitestosterone C19H28O2 MUMGGOZAMZWBJJ-KZYORJDKSA-N -BMDB00630 111.043261797 Cytosine C4H5N3O OPTASPLRGRRNAP-UHFFFAOYSA-N -BMDB00634 130.02660868 "Citraconic acid" C5H6O4 HNEGQIOMVPPMNR-IHWYPQMZSA-N -BMDB00638 200.177630012 "Dodecanoic acid" C12H24O2 POULHZVOKOAJMA-UHFFFAOYSA-N -BMDB00641 146.069142196 L-Glutamine C5H10N2O3 ZDXPYRJPNDTMRX-VKHMYHEASA-N -BMDB00645 260.029718526 "Galactose 1-phosphate" C6H13O9P HXXFSFRBOHSIMQ-FPRJBGLDSA-N -BMDB00646 150.05282343 L-Arabinose C5H10O5 SRBFZHDQGSBBOR-HWQSCIPKSA-N -BMDB00650 103.063328537 "D-Alpha-aminobutyric acid" C4H9NO2 QWCKQJZIFLGMSD-GSVOUGTGSA-N -BMDB00657 62.929601079 Copper Cu JPVYNHNXODAKFH-UHFFFAOYSA-N -BMDB00660 180.063388116 D-Fructose C6H12O6 RFSUNEUAIZKAJO-ARQDHWQXSA-N -BMDB00662 18.998403205 Fluorine F KRHYYFGTRYWZRS-UHFFFAOYSA-M -BMDB00663 210.037567296 "Glucaric acid" C6H10O8 DSLZVSRJTYRBFB-LLEIAEIESA-N -BMDB00666 130.099379692 "Heptanoic acid" C7H14O2 MNWFXJYAOYHMED-UHFFFAOYSA-N -BMDB00669 152.047344122 "Ortho-Hydroxyphenylacetic acid" C8H8O3 CCVYRRGZDBSHFU-UHFFFAOYSA-N -BMDB00670 188.127325776 Homo-L-arginine C7H16N4O2 QUOGESRFPZDMMT-YFKPBYRVSA-N -BMDB00673 280.240230268 "Linoleic acid" C18H32O2 OYHQOLUKZRVURQ-HZJYTTRNSA-N -BMDB00675 253.80893684 Iodine I2 PNDPGZBMCMUPRI-UHFFFAOYSA-N -BMDB00684 208.08479226 L-Kynurenine C10H12N2O3 YGPSJZOEDVAXAB-QMMMGPOBSA-N -BMDB00687 131.094628665 L-Leucine C6H13NO2 ROHFNLRQFUQHCH-YFKPBYRVSA-N -BMDB00688 245.162708229 Isovalerylcarnitine C12H23NO4 IGQBPDJNUXPEMT-UHFFFAOYSA-N -BMDB00691 104.010958616 "Malonic acid" C3H4O4 OFOBLEOULBTSOW-UHFFFAOYSA-N -BMDB00692 55.934942133 Iron Fe CWYNVVGOOAEACU-UHFFFAOYSA-N -BMDB00696 149.051049291 L-Methionine C5H11NO2S FFEARJCKVFRZRR-BYPYZUCNSA-N -BMDB00704 179.044324429 Isoxanthopterin C6H5N5O2 GLKCOBIIZKYKFN-UHFFFAOYSA-N -BMDB00707 180.042258744 "4-Hydroxyphenylpyruvic acid" C9H8O4 ZHLWCBHWYUISFY-UHFFFAOYSA-N -BMDB00714 179.058243159 "Hippuric acid" C9H9NO3 QIAFMBKCNZACKA-UHFFFAOYSA-N -BMDB00716 129.078978601 "L-Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-YFKPBYRVSA-N -BMDB00718 102.068079564 "Isovaleric acid" C5H10O2 GWYFCOCPABKNJV-UHFFFAOYSA-N -BMDB00719 119.058243159 L-Homoserine C4H9NO3 UKAUYVFTDYCKQA-VKHMYHEASA-N -BMDB00721 172.08479226 Glycylproline C7H12N2O3 KZNQNBZMBZJQJO-UHFFFAOYSA-N -BMDB00725 131.058243159 Hydroxyproline C5H9NO3 PMMYEEVYMWASQN-DMTCNVIQSA-N -BMDB00736 231.147058165 Isobutyryl-L-carnitine C11H21NO4 LRCNOZRCYBNMEP-UHFFFAOYSA-N -BMDB00742 135.035399227 Homocysteine C4H9NO2S FFFHZYDWPBMWHY-UHFFFAOYSA-N -BMDB00744 134.021523302 "Malic acid" C4H6O5 BJEPYKJPYRNKOW-UHFFFAOYSA-N -BMDB00750 168.042258744 "3-Hydroxymandelic acid" C8H8O4 OLSDAJRAVOVKLG-UHFFFAOYSA-N -BMDB00755 182.057908808 "Hydroxyphenyllactic acid" C9H10O4 JVGVDSSUAVXRDY-UHFFFAOYSA-N -BMDB00759 188.116092388 Glycyl-L-leucine C8H16N2O3 DKEXFJVMVGETOO-LURJTMIESA-N -BMDB00765 182.07903818 Mannitol C6H14O6 FBPFZTCFMRRESA-KVTDHHQDSA-N -BMDB00767 244.069536126 Pseudouridine C9H12N2O6 PTJWIQPHWPFNBW-GBNDHIKLSA-N -BMDB00772 298.28718046 "Nonadecanoic acid" C19H38O2 ISYWECDDZWTKFF-UHFFFAOYSA-N -BMDB00791 287.209658421 L-Octanoylcarnitine C15H29NO4 CXTATJFJDMJMIY-CYBMUJFWSA-N -BMDB00801 312.302830524 "Phytanic acid" C20H40O2 RLCKHJSFHOZMDR-UHFFFAOYSA-N -BMDB00806 228.20893014 "Myristic acid" C14H28O2 TUNFSRHWOTWDNC-UHFFFAOYSA-N -BMDB00807 185.99293909 "3-Phosphoglyceric acid" C3H7O7P OSJPPGNTCRNQQC-UHFFFAOYSA-N -BMDB00820 60.057514878 "Propyl alcohol" C3H8O BDERNNFJNOPAEC-UHFFFAOYSA-N -BMDB00821 193.073893223 Phenylacetylglycine C10H11NO3 UTYVDVLMYQPLQB-UHFFFAOYSA-N -BMDB00824 217.131408101 Propionylcarnitine C10H19NO4 UFAHZIUFPNSHSL-UHFFFAOYSA-N -BMDB00825 633.211628071 3'-Sialyllactose C23H39NO19 OIZGSVFYNBZVIK-FHHHURIISA-N -BMDB00826 242.224580204 "Pentadecanoic acid" C15H30O2 WQEPLUUGTLDZJY-UHFFFAOYSA-N -BMDB00827 284.271530396 "Stearic acid" C18H36O2 QIQXTHQIDYTFRH-UHFFFAOYSA-N -BMDB00828 176.043321376 "Ureidosuccinic acid" C5H8N2O5 HLKXYZVTANABHZ-REOHCLBHSA-N -BMDB00840 195.053157781 "Salicyluric acid" C9H9NO4 ONJSZLXSECQROL-UHFFFAOYSA-N -BMDB00847 158.13067982 "Pelargonic acid" C9H18O2 FBUKVWPVBMHYJY-UHFFFAOYSA-N -BMDB00855 255.0980966 "Nicotinamide riboside" C11H15N2O5 JLEBZPBDRKPWTD-TURQNECASA-O -BMDB00863 60.057514878 "Isopropyl alcohol" C3H8O KFZMGEQAYNKOFK-UHFFFAOYSA-N -BMDB00870 111.079647303 Histamine C5H9N3 NTYJJOPFIAHURM-UHFFFAOYSA-N -BMDB00876 384.33921603 "Vitamin D3" C27H44O QYSXJUFSXHHAJI-QWSSABAFSA-N -BMDB00883 117.078978601 L-Valine C5H11NO2 KZSNJWFQEVHDMF-BYPYZUCNSA-N -BMDB00884 258.08518619 Ribothymidine C10H14N2O6 DWRXFEITVBNRMK-JXOAFFINSA-N -BMDB00892 102.068079564 "Valeric acid" C5H10O2 NQPDZGIKBAWPEJ-UHFFFAOYSA-N -BMDB00900 396.33921603 Ergocalciferol C28H44O MECHNRXZTMCUDQ-RKHKHRCZSA-N -BMDB00904 175.095691297 Citrulline C6H13N3O3 RHGKLRLOHDJJDR-BYPYZUCNSA-N -BMDB00906 59.073499293 Trimethylamine C3H9N GETQZCLCWQTVFV-UHFFFAOYSA-N -BMDB00910 214.193280076 "Tridecanoic acid" C13H26O2 SZHOJFHSIKHZHA-UHFFFAOYSA-N -BMDB00925 75.068413915 "Trimethylamine N-oxide" C3H9NO UYPYRKYUKCHHIB-UHFFFAOYSA-N -BMDB00929 204.089877638 L-Tryptophan C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N -BMDB00930 148.0524295 "trans-Cinnamic acid" C9H8O2 WBYWAXJHAXSJNI-VOTSOKGWSA-N -BMDB00939 384.12158847 S-Adenosylhomocysteine C14H20N6O5S ZJUKTBDSGOFHSH-WFMPWKQPSA-N -BMDB00943 136.037173366 "Threonic acid" C4H8O5 JPIJQSOTBSSVTP-GBXIJSLDSA-N -BMDB00944 340.334130652 "Behenic acid" C22H44O2 UKMSUNONTOPOIO-UHFFFAOYSA-N -BMDB00947 186.161979948 "Undecanoic acid" C11H22O2 ZDPHROOEEOARMN-UHFFFAOYSA-N -BMDB00957 110.036779436 Pyrocatechol C6H6O2 YCIMNLLNPGFGHC-UHFFFAOYSA-N -BMDB00990 44.02621475 Acetaldehyde C2H4O IKHGUXGNUITLKF-UHFFFAOYSA-N -BMDB00991 159.125928793 "DL-2-Aminooctanoic acid" C8H17NO2 AKVBCGQVQXPRLD-UHFFFAOYSA-N -BMDB00996 153.009578407 3-Sulfinoalanine C3H7NO4S WVMUCBHSEHBMKA-REOHCLBHSA-N -BMDB01015 177.045963913 N-Formyl-L-methionine C6H11NO3S PYUSHNKNPOHWEZ-RXMQYKEDSA-N -BMDB01043 304.240230268 "Arachidonic acid" C20H32O2 YZXBAPSDXZZRGB-DOFZRALJSA-N -BMDB01051 90.031694058 Glyceraldehyde C3H6O3 MNQZXJOMYWMBOU-UHFFFAOYSA-N -BMDB01058 324.001134314 "Fructose 1,6-bisphosphate" C6H14O11P2 WSMBXSQDFPTODV-JGWLITMVSA-N -BMDB01065 137.084063979 2-Hydroxyphenethylamine C8H11NO ULSIYEODSMZIPX-UHFFFAOYSA-N -BMDB01076 260.029718526 "Fructose 1-phosphate" C6H13O9P RHKKZBWRNHGJEZ-ARQDHWQXSA-N -BMDB01080 87.068413915 4-Aminobutyraldehyde C4H9NO DZQLQEYLEYWJIB-UHFFFAOYSA-N -BMDB01081 674.238177172 (N-acetylneuraminosyl(a2-6)lactosamine) C25H42N2O19 RPSBVJXBTXEJJG-LURNZOHQSA-N -BMDB01095 589.082238179 GDP-L-fucose C16H25N5O15P2 LQEBEXMHBLQMDB-QIXZNPMTSA-N -BMDB01106 73.052763851 3-Aminopropionaldehyde C3H7NO PCXDJQZLDDHMGX-UHFFFAOYSA-N -BMDB01129 221.089937217 N-Acetylmannosamine C8H15NO6 OVRNDRQMDRJTHS-ZTVVOAFPSA-N -BMDB01147 119.021857653 "Aminomalonic acid" C3H5NO4 JINBYESILADKFW-UHFFFAOYSA-N -BMDB01160 354.349780716 "Tricosanoic acid" C23H46O2 XEZVDURJDFGERA-UHFFFAOYSA-N -BMDB01169 109.052763851 4-Aminophenol C6H7NO PLIKAWJENQZMHA-UHFFFAOYSA-N -BMDB01173 297.089560061 5'-Methylthioadenosine C11H15N5O3S WUUGFSXJNOTRMR-IOSLPCCCSA-N -BMDB01220 352.224974134 "Prostaglandin E2" C20H32O5 XEYBRNLFEZDVAW-ARSRFYASSA-N -BMDB01232 139.026943031 4-Nitrophenol C6H5NO3 BTJIUGUIPKRLHP-UHFFFAOYSA-N -BMDB01238 218.105527702 N-Acetylserotonin C12H14N2O2 MVAWJSIDNICKHF-UHFFFAOYSA-N -BMDB01247 26.981538441 Aluminum Al REDXJYDRNCIFBQ-UHFFFAOYSA-N -BMDB01254 259.045702941 "Glucosamine 6-phosphate" C6H14NO8P XHMJOUIAFHJHBW-UKFBFLRUSA-N -BMDB01256 202.215746852 Spermine C10H26N4 PFNFFQXMRSDOHW-UHFFFAOYSA-N -BMDB01257 145.157897623 Spermidine C7H19N3 ATHGHQPFGPMSJY-UHFFFAOYSA-N -BMDB01262 504.169034976 Maltotriose C18H32O16 FYGDTMLNYKFZSV-DZOUCCHMSA-N -BMDB01263 145.073893223 Allysine C6H11NO3 GFXYTQPNNXGICT-UHFFFAOYSA-N -BMDB01264 174.016437924 "Dehydroascorbic acid" C6H6O6 SBJKKFFYIZUCET-DUZGATOHSA-N -BMDB01296 666.221858406 Maltotetraose C24H42O21 LUEWUZLMQUOBSB-AYQJAVFRSA-N -BMDB01302 97.905407846 Molybdenum Mo MMVYPOCJESWGTC-UHFFFAOYSA-N -BMDB01303 63.929146578 Zinc Zn PTFCDOFLOPIGGS-UHFFFAOYSA-N -BMDB01315 33.997236608 Phosphorus H3P XYFCBTPGUUZFHI-UHFFFAOYSA-N -BMDB01316 276.024633148 "6-Phosphogluconic acid" C6H13O10P BIRSGZKFKXLSJQ-SQOUGZDYSA-N -BMDB01318 100.088815006 4-Methylpentanal C6H12O JGEGJYXHCFUMJF-UHFFFAOYSA-N -BMDB01327 84.911789341 Rubidium Rb NCCSSGKUIKYAJD-UHFFFAOYSA-N -BMDB01333 54.938049636 Manganese Mn WAEMQWOKJMHJLA-UHFFFAOYSA-N -BMDB01341 427.029414749 ADP C10H15N5O10P2 XTWYTFMLZFPYCI-KQYNXXCUSA-N -BMDB01349 79.916521828 Selenium Se HMUBNCUQSSTAIB-UHFFFAOYSA-N -BMDB01366 120.043596148 Purine C5H4N4 KDCGOANMDULRCW-UHFFFAOYSA-N -BMDB01370 190.095356946 "Diaminopimelic acid" C7H14N2O4 GMKMEZVLHJARHF-WHFBIAKZSA-N -BMDB01388 278.224580206 "Alpha-Linolenic acid" C18H30O2 DTOSIQBPPRVQHS-IUQGRGSQSA-N -BMDB01389 232.121177766 Melatonin C13H16N2O2 DRLFMBDRBRZALE-UHFFFAOYSA-N -BMDB01392 137.047678473 "p-Aminobenzoic acid" C7H7NO2 ALYNCZNDIQEVRV-UHFFFAOYSA-N -BMDB01397 363.057998961 "Guanosine monophosphate" C10H14N5O8P RQFCJASXJCIDSX-UUOKFMHZSA-N -BMDB01401 260.029718526 "Glucose 6-phosphate" C6H13O9P NBSCHQHZLSJFNQ-GASJEMHNSA-N -BMDB01406 122.048012824 Niacinamide C6H6N2O DFPAKSUCGFBDDF-UHFFFAOYSA-N -BMDB01414 88.100048394 Putrescine C4H12N2 KIDHWZJUCRJVML-UHFFFAOYSA-N -BMDB01425 350.118794504 "Estrone sulfate" C18H22O5S JKKFKPJIXZFSSB-CBZIJGRNSA-N -BMDB01429 94.95342 Phosphate O4P NBIIXXVUZAFLBC-UHFFFAOYSA-K -BMDB01431 168.089877638 Pyridoxamine C8H12N2O2 NHZMQXZHNVQTQA-UHFFFAOYSA-N -BMDB01451 206.043521072 "Lipoic acid" C8H14O2S2 AGBQKNBQESQNJD-SSDOTTSWSA-N -BMDB01475 89.904703679 Zirconium Zr GBNDTYKAOXLLID-UHFFFAOYSA-N -BMDB01478 71.949056008 Gallium GaH3 PHMDYZQXPPOZDG-UHFFFAOYSA-N -BMDB01488 123.032028409 "Nicotinic acid" C6H5NO2 PVNIIMVLHYAWGP-UHFFFAOYSA-N -BMDB01491 247.024573569 "Pyridoxal 5'-phosphate" C8H10NO6P NGVDGCNFYWLIFO-UHFFFAOYSA-N -BMDB01492 416.36543078 Gamma-Tocopherol C28H48O2 QUEDXNHFTDJVIY-UHFFFAOYSA-N -BMDB01511 211.035806957 Phosphocreatine C4H10N3O5P DRBBFCLWYRJSJZ-UHFFFAOYSA-N -BMDB01514 179.079372531 Glucosamine C6H13NO5 MSWZFWKMSRAUBD-HOWGCPQDSA-N -BMDB01518 278.151809192 Alpha-CEHC C16H22O4 AXODOWFEFKOVSH-UHFFFAOYSA-N -BMDB01539 202.14297584 Dimethyl-L-arginine C8H18N4O2 YDGMGEXADBMOMJ-LURJTMIESA-N -BMDB01545 167.058243159 Pyridoxal C8H9NO3 RADKZDMFGJYCBB-UHFFFAOYSA-N -BMDB01548 230.01915384 "D-Ribose 5-phosphate" C5H11O8P KTVPXOYAKDPRHY-SOOFDHNKSA-N -BMDB01552 145.037507717 "2-Keto-glutaramic acid" C5H7NO4 COJBGNAUUSNXHX-UHFFFAOYSA-N -BMDB01553 148.019414812 "2-Oxo-4-methylthiobutanoic acid" C5H8O3S SXFSQZDSUWACKX-UHFFFAOYSA-N -BMDB01555 248.056208048 "Pyridoxamine 5'-phosphate" C8H13N2O5P ZMJGSOSNSPKHNH-UHFFFAOYSA-N -BMDB01563 297.107318615 1-Methylguanosine C11H15N5O5 UTAIYTHAJQNQDW-KQYNXXCUSA-N -BMDB01565 184.073869485 Phosphorylcholine C5H15NO4P YHHSONZFOIEMCP-UHFFFAOYSA-O -BMDB01586 260.029718526 "Glucose 1-phosphate" C6H13O9P HXXFSFRBOHSIMQ-GASJEMHNSA-N -BMDB01645 131.094628665 L-Norleucine C6H13NO2 LRQKBLKVPFOOQJ-YFKPBYRVSA-N -BMDB01659 58.041864814 Acetone C3H6O CSCPPACGZOOCGX-UHFFFAOYSA-N -BMDB01830 314.224580204 Progesterone C21H30O2 RJKFOVLPORLFTN-LEKSSAKUSA-N -BMDB01854 129.906222753 Tellurium Te LHBANKJAFPUZQV-UHFFFAOYSA-N -BMDB01858 108.057514878 p-Cresol C7H8O IWDCLRJOBJJRNH-UHFFFAOYSA-N -BMDB01859 151.063328537 Acetaminophen C8H9NO2 RZVAJINKPMORJF-UHFFFAOYSA-N -BMDB01873 88.0524295 "Isobutyric acid" C4H8O2 KQNPFQTWMSNSAP-UHFFFAOYSA-N -BMDB01875 32.02621475 Methanol CH4O OKKJLVBELUTLKV-UHFFFAOYSA-N -BMDB01882 90.031694058 Dihydroxyacetone C3H6O3 RXKJFZQQPQGTFL-UHFFFAOYSA-N -BMDB01890 163.030313849 Acetylcysteine C5H9NO3S PWKSKIMOESPYIA-BYPYZUCNSA-N -BMDB01891 137.047678473 "m-Aminobenzoic acid" C7H7NO2 XFDUHJPVQKIXHO-UHFFFAOYSA-N -BMDB01893 430.381080844 Alpha-Tocopherol C29H50O2 GVJHHUAWPYXKBD-IEOSBIPESA-N -BMDB01903 416.329045274 Calcitriol C27H44O3 GMRQFYUYWCNGIN-NKMMMXOESA-N -BMDB01906 103.063328537 "2-Aminoisobutyric acid" C4H9NO2 FUOOLUPWFVMBKG-UHFFFAOYSA-N -BMDB01960 119.900002251 Tin Sn SYRHIZPPCHMRIT-UHFFFAOYSA-N -BMDB01964 180.042258744 "Caffeic acid" C9H8O4 QAIPRVGONGVQAS-RQOWECAXSA-N -BMDB01966 47.947947053 Titanium Ti LCKIEQZJEYYRIY-UHFFFAOYSA-N -BMDB01976 330.255880335 "Docosapentaenoic acid" C22H34O2 YEKFYCQGYMVFKR-MBFZXKRTSA-N -BMDB01999 302.224580204 "Eicosapentaenoic acid" C20H30O2 JAZBEHYOTPTENJ-JLNKQSITSA-N -BMDB02000 226.193280076 "Myristoleic acid" C14H26O2 YWWVWXASSLXJHU-WAYWQWQTSA-N -BMDB02003 368.36543078 "Tetracosanoic acid" C24H48O2 QZZGJDVWLFXDLK-UHFFFAOYSA-N -BMDB02005 165.045963913 "Methionine sulfoxide" C5H11NO3S QEFRNWWLZKMPFJ-UHFFFAOYSA-N -BMDB02013 231.147058165 Butyrylcarnitine C11H21NO4 QWYFHHGCZUCMBN-UHFFFAOYSA-N -BMDB02014 369.287908741 cis-5-Tetradecenoylcarnitine C21H39NO4 NNCBVXBBLABOCB-SEYXRHQNSA-N -BMDB02024 126.042927446 "Imidazoleacetic acid" C5H6N2O2 PRJKNHOMHKJCEJ-UHFFFAOYSA-N -BMDB02035 164.047344122 "4-Hydroxycinnamic acid" C9H8O3 NGSWKAQJJWESNS-ZZXKWVIFSA-N -BMDB02040 178.062994186 "4-Methoxycinnamic acid" C10H10O3 AFDXODALSZRGIH-QPJJXVBHSA-N -BMDB02048 108.057514878 m-Cresol C7H8O RLSSMJSEOOYNOY-UHFFFAOYSA-N -BMDB02055 108.057514878 o-Cresol C7H8O QWVGKYWNOKOFNN-UHFFFAOYSA-N -BMDB02064 130.11061308 N-Acetylputrescine C6H14N2O KLZGKIDSEJWEDW-UHFFFAOYSA-N -BMDB02068 338.318480592 "Erucic acid" C22H42O2 DPUOLQHDNGRHBS-MDZDMXLPSA-N -BMDB02092 130.02660868 "Itaconic acid" C5H6O4 LVHBHZANLOWSRM-UHFFFAOYSA-N -BMDB02111 18.010564686 Water H2O XLYOFNOQVPJJNP-UHFFFAOYSA-N -BMDB02142 97.976895096 "Phosphoric acid" H3O4P NBIIXXVUZAFLBC-UHFFFAOYSA-N -BMDB02151 78.013935504 "Dimethyl sulfoxide" C2H6OS IAZDPXIOMUYVGZ-UHFFFAOYSA-N -BMDB02174 1328.564331295 Cobalamin C62H88CoN13O14P NSLAUEAQDBERRV-UHFFFAOYSA-L -BMDB02177 304.24023027 "8,11,14,17-Eicosatetraenoic acid" C20H32O2 HQPCSDADVLFHHO-GFRMADBLSA-N -BMDB02183 328.240230268 "Docosahexaenoic acid" C22H32O2 MBMBGCFOFBJSGT-KUBAVDMBSA-N -BMDB02196 208.980383241 Bismuth Bi JDIBGQFKXXXXPN-UHFFFAOYSA-N -BMDB02209 242.094294314 Equol C15H14O3 ADFCQWZHKCXPAJ-GFCCVEGCSA-N -BMDB02210 151.063328537 2-Phenylglycine C8H9NO2 ZGUNAGUHMKGQNY-UHFFFAOYSA-N -BMDB02212 312.302830524 "Arachidic acid" C20H40O2 VKOBVWXKNCXXDE-UHFFFAOYSA-N -BMDB02226 332.271530399 "Adrenic acid" C22H36O2 TWSWSIQAPQLDBP-CGRWFSSPSA-N -BMDB02231 310.28718046 "Eicosenoic acid" C20H38O2 BITHHVVYSMSWAG-KTKRTIGZSA-N -BMDB02250 343.272258677 Dodecanoylcarnitine C19H37NO4 FUJLYHJROOYKRA-QGZVFWFLSA-N -BMDB02259 270.255880332 "Heptadecanoic acid" C17H34O2 KEMQGTRYUADPNZ-UHFFFAOYSA-N -BMDB02285 161.047678473 "2-Indolecarboxylic acid" C9H7NO2 HCUARRIEZVDMPT-UHFFFAOYSA-N -BMDB02287 117.024834541 "Homocysteine thiolactone" C4H7NOS KIWQWJKWBHZMDT-UHFFFAOYSA-N -BMDB02290 74.921596417 Arsenic As LULLIKNODDLMDQ-UHFFFAOYSA-N -BMDB02329 89.995308552 "Oxalic acid" C2H2O4 MUBZPKHOEPUJKR-UHFFFAOYSA-N -BMDB02338 284.068473486 "Biochanin A" C16H12O5 WUADCCWRTIWANL-UHFFFAOYSA-N -BMDB02339 234.100442324 5-Methoxytryptophan C12H14N2O3 KVNPSKDDJARYKK-JTQLQIEISA-N -BMDB02345 326.318480588 "Heneicosanoic acid" C21H42O2 CKDDRHZIAZRDBW-UHFFFAOYSA-N -BMDB02386 11.009305466 Boron B FRWDHMWMHYXNLW-UHFFFAOYSA-N -BMDB02393 147.053157781 "N-Methyl-D-aspartic acid" C5H9NO4 HOKKHZGPKSLGJE-GSVOUGTGSA-N -BMDB02457 57.935347922 Nickel Ni VEQPNABPJHWNSG-UHFFFAOYSA-N -BMDB02503 50.943963675 Vanadium V KOKKJWHERHSKEB-UHFFFAOYSA-N -BMDB02511 238.084123558 "3,4,5-Trimethoxycinnamic acid" C12H14O5 YTFVRYKNXDADBI-SNAWJCMRSA-N -BMDB02520 172.013674532 "Beta-Glycerophosphoric acid" C3H9O6P DHCLVCXQIBBOPH-UHFFFAOYSA-N -BMDB02545 194.042652674 "Galacturonic acid" C6H10O7 IAJILQKETJEXLJ-RSJOWCBRSA-N -BMDB02670 272.068473494 Naringenin C15H12O5 FTVWIRXFELQLPI-ZDUSSCGKSA-N -BMDB02789 568.428031043 Zeaxanthin C40H56O2 JKQXZKUSFCKOGQ-QAYBQHTQSA-N -BMDB02815 521.348139535 LysoPC(18:1(9Z)) C26H52NO7P YAMUFBLWGFFICM-PTGWMXDISA-N -BMDB02894 125.058911861 5-Methylcytosine C5H7N3O LRSASMSXMSNRBT-UHFFFAOYSA-N -BMDB02902 402.349780716 Delta-Tocopherol C27H46O2 GZIFEOYASATJEH-VHFRWLAGSA-N -BMDB02923 342.116211546 Isomaltose C12H22O11 DLRVVLDZNNYCBX-RTPHMHGBSA-N -BMDB02925 306.255880332 "8,11,14-Eicosatrienoic acid" C20H34O2 HOBAELRKJCKHQD-QNEBEIHSSA-N -BMDB03011 147.053157781 O-Acetylserine C5H9NO4 VZXPDPZARILFQX-BYPYZUCNSA-N -BMDB03012 93.057849229 Aniline C6H7N PAYRUJLWNCNPSJ-UHFFFAOYSA-N -BMDB03073 278.224580204 "Gamma-Linolenic acid" C18H30O2 VZCCETWTMQHEPK-QNEBEIHSSA-N -BMDB03217 270.052823422 Genistein C15H10O5 TZBJGXHYKVUXJN-UHFFFAOYSA-N -BMDB03227 48.003370818 Methanethiol CH4S LSDPWZHWYPCBBB-UHFFFAOYSA-N -BMDB03229 254.224580204 "Palmitoleic acid" C16H30O2 SECPZKHBENQXJG-FPLPWBNLSA-N -BMDB03231 282.255880335 "Vaccenic acid" C18H34O2 UWHZIFQPPBDJPM-BQYQJAHWSA-N -BMDB03233 568.428031036 Lutein C40H56O2 KBPHJBAIARWVSC-RTIVXWJOSA-N -BMDB03276 33.987720754 "Hydrogen sulfide" H2S RWSOTUBLDIXVET-UHFFFAOYSA-N -BMDB03312 254.057908802 Daidzein C15H10O4 ZQSIJRDFPHDXIC-UHFFFAOYSA-N -BMDB03331 281.112403993 1-Methyladenosine C11H15N5O4 GFYLSDSUCHVORB-IOSLPCCCSA-N -BMDB03338 33.021463723 Hydroxylamine H3NO AVXURJPOCDRRFD-UHFFFAOYSA-N -BMDB03339 147.053157781 "D-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-GSVOUGTGSA-N -BMDB03349 158.03275669 "L-Dihydroorotic acid" C5H6N2O4 UFIVEPVSAGBUSI-REOHCLBHSA-N -BMDB03355 117.078978601 "5-Aminopentanoic acid" C5H11NO2 JJMDCOVWQOJGCB-UHFFFAOYSA-N -BMDB03357 174.100442324 N-Acetylornithine C7H14N2O3 JRLGPAXAGHMNOL-LURJTMIESA-N -BMDB03361 80.037448138 Pyrimidine C4H4N2 CZPWVGJYEJSRLH-UHFFFAOYSA-N -BMDB03371 150.05282343 L-Ribulose C5H10O5 LQXVFWRQNMEDEE-OVEKKEMJSA-N -BMDB03375 136.125200512 (-)-Limonene C10H16 XMGQYMWWDOXHJM-SNVBAGLBSA-N -BMDB03378 29.997988627 "Nitric oxide" NO MWUXSHHQAYIFBG-UHFFFAOYSA-N -BMDB03402 194.042652674 Pectin C6H10O7 AEMOLEFTQBMNLQ-DTEWXJGMSA-N -BMDB03407 86.036779436 Diacetyl C4H6O2 QSJXEFYPDANLFS-UHFFFAOYSA-N -BMDB03429 1328.564326 Cob(I)alamin C62H88CoN13O14P SJBNFITWNDPBKE-FWTZXHJXSA-N -BMDB03431 141.090211989 L-Histidinol C6H11N3O ZQISRDCJNBUVMM-YFKPBYRVSA-N -BMDB03449 180.063388116 Beta-D-Galactose C6H12O6 WQZGKKKJIJFFOK-FPRJBGLDSA-N -BMDB03459 160.08479226 D-Alanyl-D-alanine C6H12N2O3 DEFJQIDDEAULHB-QWWZWVQMSA-N -BMDB03543 72.057514878 Butanal C4H8O ZTQSAGDEMFDKMZ-UHFFFAOYSA-N -BMDB03550 400.334130652 Calcidiol C27H44O2 JWUBBDSIWDLEOM-DTOXIADCSA-N -BMDB03555 450.349780716 "Vitamin K1" C31H46O2 MBWXNTAXLNYFJB-LKUDQCMESA-N -BMDB03625 201.970625604 Mercury Hg BQPIGGFYSBELGY-UHFFFAOYSA-N -BMDB03638 113.903358121 Cadmium Cd WLZRMCYVCSSEQC-UHFFFAOYSA-N -BMDB03642 87.905614339 Strontium Sr PWYYWQHXAPXYMF-UHFFFAOYSA-N -BMDB03671 114.10446507 2-Heptanone C7H14O CATSNJVOTSVZJV-UHFFFAOYSA-N -BMDB03681 145.073893223 "4-Acetamidobutanoic acid" C6H11NO3 UZTFMUBKZQVKLK-UHFFFAOYSA-N -BMDB03797 280.240230268 "Bovinic acid" C18H32O2 JBYXPOFIGCOSSB-GOJKSUSPSA-N -BMDB03911 103.063328537 "3-Aminoisobutanoic acid" C4H9NO2 QCHPKSFMDHPSNR-UHFFFAOYSA-N -BMDB04095 190.11061308 5-Methoxytryptamine C11H14N2O JTEJPPKMYBDEMY-UHFFFAOYSA-N -BMDB04096 205.073893223 5-Methoxyindoleacetate C11H11NO3 COCNDHOPIHDTHK-UHFFFAOYSA-N -BMDB04118 120.903818044 Antimony Sb FAWGZAFXDJGWBB-UHFFFAOYSA-N -BMDB04142 137.905241273 Barium Ba XDFCIPNJCBUZJN-UHFFFAOYSA-N -BMDB04215 244.073558866 3,3',4'5-Tetrahydroxystilbene C14H12O4 CDRPUGZCRXZLFL-OWOJBTEDSA-N -BMDB04327 74.073164942 1-Butanol C4H10O LRHPLDYGYMQRHN-UHFFFAOYSA-N -BMDB04370 174.115698458 N-Methyltryptamine C11H14N2 NCIKQJBVUNUXLW-UHFFFAOYSA-N -BMDB04437 105.078978601 Diethanolamine C4H11NO2 ZBCBWPMODOFKDW-UHFFFAOYSA-N -BMDB04483 446.194067936 "Estrone glucuronide" C24H30O8 FJAZVHYPASAQKM-JBAURARKSA-N -BMDB04628 207.97663585 Lead Pb RVPVRDXYQKGNMQ-UHFFFAOYSA-N -BMDB04983 94.008850126 "Dimethyl sulfone" C2H6O2S HHVIBTZHLRERCL-UHFFFAOYSA-N -BMDB05047 280.240230268 "9E,11E-Octadecadienoic acid" C18H32O2 JBYXPOFIGCOSSB-XBLVEGMJSA-N -BMDB05048 280.240230268 "10E,12Z-Octadecadienoic acid" C18H32O2 JBYXPOFIGCOSSB-UQGDGPGGSA-N -BMDB05056 302.151809192 Enterodiol C18H22O4 DWONJCNDULPHLV-HOTGVXAUSA-N -BMDB05060 308.271530396 "Eicosadienoic acid" C20H36O2 XSXIVVZCUAHUJO-HZJYTTRNSA-N -BMDB05066 371.303558805 Tetradecanoylcarnitine C21H41NO4 PSHXNVGSVNEJBD-LJQANCHMSA-N -BMDB05356 806.736340868 TG(16:0/16:0/16:0)[iso] C51H98O6 PVNIQBQSYATKKL-UHFFFAOYSA-N -BMDB05357 834.767640996 TG(16:0/16:0/18:0)[iso3] C53H102O6 DQKMNCLZNGAXNX-VCZQVZGSSA-N -BMDB05358 862.798941124 TG(16:0/16:0/20:0)[iso3] C55H106O6 YDZWEVBRICYXOV-OIVUAWODSA-N -BMDB05359 804.720690804 TG(16:0/16:0/16:1(9Z))[iso3] C51H96O6 FEKLSEFRUGWUOS-DLOIZKPKSA-N -BMDB05360 832.751990932 TG(16:0/16:0/18:1(9Z))[iso3] C53H100O6 YHMDGPZOSGBQRH-YYSBDVFPSA-N -BMDB05361 860.78329106 TG(16:0/16:0/20:1(11Z))[iso3] C55H104O6 XRTUKMLVVRMOLM-PLYDGSRGSA-N -BMDB05362 830.736340868 TG(16:0/16:0/18:2(9Z,12Z))[iso3] C53H98O6 MTWYSKGJIDFSRC-IICCMCGVSA-N -BMDB05363 854.736340868 TG(16:0/16:0/20:4(5Z,8Z,11Z,14Z))[iso3] C55H98O6 FTMDHBKIGZUTJX-MRKXGPBNSA-N -BMDB05365 862.798941124 TG(16:0/18:0/18:0)[iso3] C55H106O6 SDNYRTVJOFMYIW-UHFFFAOYSA-N -BMDB05366 890.830241252 TG(16:0/18:0/20:0)[iso6] C57H110O6 DHDAMQPBPJWJEI-AXAMJWTMSA-N -BMDB05367 860.78329106 TG(16:0/18:0/18:1(9Z))[iso6] C55H104O6 NPCZZYKITFKRQZ-RFBIWTDZSA-N -BMDB05369 858.767640996 TG(16:0/18:0/18:2(9Z,12Z))[iso6] C55H102O6 MDCUASFVKLEFPW-AXYZMXSISA-N -BMDB05370 882.767640996 TG(16:0/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H102O6 IBSUTTNKAUSOHR-RHFYBLIZSA-N -BMDB05374 832.751990932 TG(16:0/16:1(9Z)/18:0)[iso6] C53H100O6 YSNGWXHIKNKBNE-NURROHNTSA-N -BMDB05375 860.78329106 TG(16:0/16:1(9Z)/20:0)[iso6] C55H104O6 XFUMCVMRUALVIH-FQFQCYJKSA-N -BMDB05376 802.70504074 TG(16:0/16:1(9Z)/16:1(9Z))[iso3] C51H94O6 RUOVJPPUXXFZPC-YZEIBMOJSA-N -BMDB05377 830.736340868 TG(16:0/16:1(9Z)/18:1(9Z))[iso6] C53H98O6 TWJCMQZMAPGUSG-JMFJKIOKSA-N -BMDB05378 858.767640996 TG(16:0/16:1(9Z)/20:1(11Z))[iso6] C55H102O6 IHIYITLVGJUTBO-BPSHQJQISA-N -BMDB05379 828.720690804 TG(16:0/16:1(9Z)/18:2(9Z,12Z))[iso6] C53H96O6 HDFLQJUGWGNORO-BJPYDGQASA-N -BMDB05380 852.720690804 TG(16:0/16:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C55H96O6 BURBQZUNMNAKMA-UQVRGOOMSA-N -BMDB05382 858.767640996 TG(16:0/18:1(9Z)/18:1(9Z))[iso3] C55H102O6 JFISYPWOVQNHLS-LBXGSASVSA-N -BMDB05383 886.798941124 TG(16:0/18:1(9Z)/20:1(11Z))[iso6] C57H106O6 FPUBLSPUCGHELU-AWEKCPRFSA-N -BMDB05384 856.751990932 TG(16:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C55H100O6 KGLAHZTWGPHKFF-RISKEULASA-N -BMDB05385 880.751990932 TG(16:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H100O6 KKABVOCYVJCRKP-PZOQESJISA-N -BMDB05386 914.830241252 TG(16:0/20:1(11Z)/20:1(11Z))[iso3] C59H110O6 OJBGBKUEIBXOEG-YYEKOYDESA-N -BMDB05388 886.798941124 TG(16:0/18:2(9Z,12Z)/20:0)[iso6] C57H106O6 KWUMWJZHUAQZMT-IEHWOXSQSA-N -BMDB05389 884.78329106 TG(16:0/18:2(9Z,12Z)/20:1(11Z))[iso6] C57H104O6 YZEDZPDPXZLZNB-YIECYNBOSA-N -BMDB05390 854.736340868 TG(16:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C55H98O6 LXAWUIOWWNQCQA-HFHWEOLTSA-N -BMDB05391 878.736340868 TG(16:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H98O6 NIQCHCDUIPSWDJ-DODJOXOJSA-N -BMDB05393 890.830241252 TG(18:0/18:0/18:0) C57H110O6 DCXXMTOCNZCJGO-UHFFFAOYSA-N -BMDB05395 888.814591188 TG(18:0/18:0/18:1(9Z))[iso3] C57H108O6 YFFIQXNTTVSKJC-NZEOUKRFSA-N -BMDB05397 886.798941124 TG(18:0/18:0/18:2(9Z,12Z))[iso3] C57H106O6 ABFJWRKPWCFTQP-JKFVOKSPSA-N -BMDB05403 886.798941124 TG(18:0/18:1(9Z)/18:1(9Z))[iso3] C57H106O6 RYNHWWNZNIGDAQ-BMTCQUSZSA-N -BMDB05404 914.830241252 TG(18:0/18:1(9Z)/20:1(11Z))[iso6] C59H110O6 OWMDNFFJJVRJMG-BMPUKRIOSA-N -BMDB05405 884.78329106 TG(18:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C57H104O6 CNGSOZKJBWHOEG-KRNHIMMGSA-N -BMDB05407 942.86154138 TG(18:0/20:1(11Z)/20:1(11Z))[iso3] C61H114O6 AFFQVAIMWFYJJS-DTHFMEMVSA-N -BMDB05409 914.830241252 TG(18:0/18:2(9Z,12Z)/20:0)[iso6] C59H110O6 PDEQUPGHMOMBFC-FYEHETCMSA-N -BMDB05411 882.767640996 TG(18:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C57H102O6 PJHDLKOEJMDTBE-XSHDOBLLSA-N -BMDB05412 906.767640996 TG(18:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C59H102O6 CKEOSPBKHRUVTN-CTKOWQHDSA-N -BMDB05421 860.78329106 TG(16:1(9Z)/18:0/18:0)[iso3] C55H104O6 CDKITPQUODTFLF-FQFQCYJKSA-N -BMDB05423 858.767640996 TG(16:1(9Z)/18:0/18:1(9Z))[iso6] C55H102O6 SZXNLYZNXCGSMY-JWVPJFKJSA-N -BMDB05424 886.798941124 TG(16:1(9Z)/18:0/20:1(11Z))[iso6] C57H106O6 MMEBJAFEPYJMGH-MOJLPSOPSA-N -BMDB05425 856.751990932 TG(16:1(9Z)/18:0/18:2(9Z,12Z))[iso6] C55H100O6 HLYOUKKBNQIMLH-CYRKDGISSA-N -BMDB05426 880.751990932 TG(16:1(9Z)/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H100O6 ITWBZDOMDJKFCH-PXZCBWGVSA-N -BMDB05428 914.830241252 TG(16:1(9Z)/20:0/20:1(11Z))[iso6] C59H110O6 XOCUQHRPEPNSJE-HVYAKTSASA-N -BMDB05430 830.736340868 TG(16:1(9Z)/16:1(9Z)/18:0)[iso3] C53H98O6 QEZWFCZNHWUARW-XQCAQTCHSA-N -BMDB05431 858.767640996 TG(16:1(9Z)/16:1(9Z)/20:0)[iso3] C55H102O6 KKJVTOLWRSMFEP-RLVGKUCASA-N -BMDB05432 800.689390676 "TG(16:1(9Z)/16:1(9Z)/16:1(9Z))[iso] " C51H92O6 SKGWNZXOCSYJQL-BUTYCLJRSA-N -BMDB05433 828.720690804 TG(16:1(9Z)/16:1(9Z)/18:1(9Z))[iso3] C53H96O6 UFHNZOACKFBCOM-YXKNDSBASA-N -BMDB05434 856.751990932 TG(16:1(9Z)/16:1(9Z)/20:1(11Z))[iso3] C55H100O6 YCIPIGLQWOQUJK-PKTDIELCSA-N -BMDB05435 826.70504074 TG(16:1(9Z)/16:1(9Z)/18:2(9Z,12Z))[iso3] C53H94O6 PVMBAGXWHHZKFP-JMPJWMFJSA-N -BMDB05436 850.70504074 TG(16:1(9Z)/16:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso3] C55H94O6 SWYCMJAKZYLTJN-FKAQGJMVSA-N -BMDB05437 886.798941124 TG(16:1(9Z)/18:1(9Z)/20:0)[iso6] C57H106O6 INYBBHQUSIBINH-OMJPTUBSSA-N -BMDB05438 856.751990932 TG(16:1(9Z)/18:1(9Z)/18:1(9Z))[iso3] C55H100O6 YBWITEZBUYUNFC-GUIYCBLGSA-N -BMDB05439 884.78329106 TG(16:1(9Z)/18:1(9Z)/20:1(11Z))[iso6] C57H104O6 OVEMPQUFJMCLKI-KEKYZYDQSA-N -BMDB05440 854.736340868 TG(16:1(9Z)/18:1(9Z)/18:2(9Z,12Z))[iso6] C55H98O6 WHSWXEYWNPTUPW-HNJDVRDNSA-N -BMDB05441 878.736340868 TG(16:1(9Z)/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H98O6 CDNDFDKFZBPPFW-AXJGXPKFSA-N -BMDB05443 906.767640996 TG(16:1(9Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C59H102O6 NNCCJKNBYUHUAL-QRHSWZDZSA-N -BMDB05444 884.78329106 TG(16:1(9Z)/18:2(9Z,12Z)/20:0)[iso6] C57H104O6 MSQBYCWSXAUJHK-YNTROPROSA-N -BMDB05445 882.767640996 TG(16:1(9Z)/18:2(9Z,12Z)/20:1(11Z))[iso6] C57H102O6 SZYBCITYDACFEY-YJXCAZQISA-N -BMDB05446 852.720690804 TG(16:1(9Z)/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C55H96O6 CQZAAIKPSLHIBC-KDJOUNIJSA-N -BMDB05447 876.720690804 TG(16:1(9Z)/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H96O6 VUNSQJRBLNQFPQ-PGGPBQQQSA-N -BMDB05450 942.86154138 TG(18:1(9Z)/20:0/20:1(11Z))[iso6] C61H114O6 QEBMDFMPVYJRFG-WLPFSFTESA-N -BMDB05452 914.830241252 TG(18:1(9Z)/18:1(9Z)/20:0)[iso3] C59H110O6 JFKGKULDMWLHEK-KMERLIGUSA-N -BMDB05453 884.78329106 TG(18:1(9Z)/18:1(9Z)/18:1(9Z))[iso] C57H104O6 PHYFQTYBJUILEZ-IUPFWZBJSA-N -BMDB05455 882.767640996 TG(18:1(9Z)/18:1(9Z)/18:2(9Z,12Z))[iso3] C57H102O6 JTMWOTXEVWLTTO-YKZMILTLSA-N -BMDB05456 906.767640996 TG(18:1(9Z)/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso3] C59H102O6 CKSBRWXVWDFKJD-ALCWIDLZSA-N -BMDB05457 940.845891316 TG(18:1(9Z)/20:1(11Z)/20:1(11Z))[iso3] C61H112O6 RFMSTHTUAZETPD-JJPHLYBUSA-N -BMDB05461 880.751990932 TG(18:1(9Z)/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C57H100O6 VVEBTVMJPTZDHO-YQFZQLSNSA-N -BMDB05464 968.877191444 TG(20:1(11Z)/20:1(11Z)/20:1(11Z)) C63H116O6 XKXYLRHFXANGHG-IUPFWZBJSA-N -BMDB05467 942.86154138 TG(18:2(9Z,12Z)/20:0/20:0)[iso3] C61H114O6 VYGDFJHLNCSFJZ-GDTJZKNMSA-N -BMDB05468 940.845891316 TG(18:2(9Z,12Z)/20:0/20:1(11Z))[iso6] C61H112O6 WYUNJFXMLHILJN-MSTBSTCSSA-N -BMDB05474 878.736340868 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C57H98O6 HBOQXIRUPVQLKX-BBWANDEASA-N -BMDB05781 284.068473486 Glycitein C16H12O5 DXYUAIFZCFRPTH-UHFFFAOYSA-N -BMDB05805 134.109550451 p-Cymene C10H14 HFPZCAJZSCWRBC-UHFFFAOYSA-N -BMDB05808 268.073558866 Formononetin C16H12O4 HKQYGTCOTHHOMP-UHFFFAOYSA-N -BMDB05842 100.088815006 2-Oxohexane C6H12O QQZOPKMRPOGIEB-UHFFFAOYSA-N -BMDB05862 297.107318615 2-Methylguanosine C11H15N5O5 SLEHROROQDYRAW-KQYNXXCUSA-N -BMDB05879 93.991091572 Dimethyldisulfide C2H6S2 WQOXQRCZOLPYPM-UHFFFAOYSA-N -BMDB05949 7.016004049 Lithium Li HBBGRARXTFLTSG-UHFFFAOYSA-N -BMDB05960 129.078978601 "D-Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-RXMQYKEDSA-N -BMDB05994 100.088815006 Hexanal C6H12O JARKCYVAAOWBJS-UHFFFAOYSA-N -BMDB06006 74.073164942 Isobutanol C4H10O ZXEKIIBDNHEJCQ-UHFFFAOYSA-N -BMDB06007 88.088815006 Isopentanol C5H12O PHTQWCKDNZKARW-UHFFFAOYSA-N -BMDB06024 130.062994186 Mevalonolactone C6H10O3 JYVXNLLUYHCIIH-LURJTMIESA-N -BMDB06050 181.073893223 o-Tyrosine C9H11NO3 WRFPVMFCRNYQNR-UHFFFAOYSA-N -BMDB06101 298.120509064 Enterolactone C18H18O4 HVDGDHBAMCBBLR-UHFFFAOYSA-N -BMDB06224 448.209718 17-beta-estradiol-3-glucuronide C24H32O8 MUOHJTRCBBDUOW-BFXFFQJBSA-N -BMDB06236 120.057514878 Phenylacetaldehyde C8H8O DTUQWGWMVIHBKE-UHFFFAOYSA-N -BMDB06246 360.302830528 "Tetracosatetraenoic acid n-6" C24H40O2 RZHACVKGHNMWOP-ZWZRQGCWSA-N -BMDB06270 280.240230268 "Linoelaidic acid" C18H32O2 OYHQOLUKZRVURQ-AVQMFFATSA-N -BMDB06322 358.28718046 "Tetracosapentaenoic acid (24:5n-6)" C24H38O2 VENRYLMOFDSSDJ-WMPRHZDHSA-N -BMDB06323 358.28718046 "Tetracosapentaenoic acid (24:5n-3)" C24H38O2 NPTIBOCVSPURCS-JLNKQSITSA-N -BMDB06478 86.073164942 Iso-Valeraldehyde C5H10O YGHRJJRRZDOVPD-UHFFFAOYSA-N -BMDB06483 133.037507717 "D-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-UWTATZPHSA-N -BMDB06525 136.125200515 (+)-a-Pinene C10H16 GRWFGVWFFZKLTI-UHFFFAOYSA-N -BMDB06528 330.255880332 "Clupanodonic acid" C22H34O2 YUFFSWGQGVEMMI-JLNKQSITSA-N -BMDB06547 276.208930142 "Stearidonic acid" C18H28O2 JIWBIWFOSCKQMA-GFRMADBLSA-N -BMDB06569 633.211628071 6'-Sialyllactose C23H39NO19 VMWYCXKMRSTDSP-GIGDJUIZSA-N -BMDB06692 924.307044596 Disialyllactose C34H56N2O27 IESOVNOGVZBLMG-MTEFBGAJSA-N -BMDB06773 302.188194697 11b-Hydroxyandrost-4-ene-3,17-dione C19H26O3 WSCUHXPGYUMQEX-CRIVMUBDSA-N -BMDB06779 147.032028409 Indole-5,6-quinone C8H5NO2 IGGVVGHJSQSLFO-UHFFFAOYSA-N -BMDB06953 390.05632767 1-Phosphatidyl-D-myo-inositol C11H19O13P GUBXYMKIJFOYOA-RYJPWIOHSA-N -BMDB07033 614.491025222 DG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0) C39H66O5 UNAUUXGPAPFTQK-MTCOIHPXSA-N -BMDB07102 594.52232535 DG(16:0/18:1(9Z)/0:0) C37H70O5 YEJYLHKQOBOSCP-OZKTZCCCSA-N -BMDB07128 564.475375158 DG(16:1(9Z)/16:1(9Z)/0:0) C35H64O5 HSQHRRHRYJNSOC-DWCRPSDDSA-N -BMDB07214 594.52232535 DG(18:1(9Z)/16:0/0:0) C37H70O5 DOZKMFVMCATMEH-OZKTZCCCSA-N -BMDB07218 620.537975414 DG(18:1(9Z)/18:1(9Z)/0:0) C39H72O5 AFSHUZFNMVJNKX-LLWMBOQKSA-N -BMDB07361 652.60057567 DG(20:0/18:0/0:0) C41H80O5 SCGCTMVKIGULND-KDXMTYKHSA-N -BMDB07867 675.483904733 PC(14:0/14:1(9Z)) C36H70NO8P SNDOMDWDQRZWFS-NOLSVFIGSA-N -BMDB07868 691.515204861 PC(14:0/15:0) C37H74NO8P JERIBPHBOOFETI-PGUFJCEWSA-N -BMDB07869 705.530854925 PC(14:0/16:0) C38H76NO8P RFVFQQWKPSOBED-PSXMRANNSA-N -BMDB07870 703.515204861 PC(14:0/16:1(9Z)) C38H74NO8P XGGMHQYOVYWRLV-IZNHTBNISA-N -BMDB07871 733.562155053 PC(14:0/18:0) C40H80NO8P TYAQXZHDAGZOEO-KXQOOQHDSA-N -BMDB07873 731.546504989 PC(14:0/18:1(9Z)) C40H78NO8P NXASLICYTANYBI-OQHNRNOKSA-N -BMDB07874 729.530854925 PC(14:0/18:2(9Z,12Z)) C40H76NO8P IWXJKHSPEQSQMD-GMGFYYQASA-N -BMDB07875 727.515204861 PC(14:0/18:3(6Z,9Z,12Z)) C40H74NO8P VZQRMZUULSWEHB-XCFXQIAYSA-N -BMDB07876 727.515204861 PC(14:0/18:3(9Z,12Z,15Z)) C40H74NO8P AGQKQQAJRFTOGL-XPTMXNASSA-N -BMDB07878 761.593455181 PC(14:0/20:0) C42H84NO8P VELOKQJUJJVGMB-RRHRGVEJSA-N -BMDB07879 759.577805117 PC(14:0/20:1(11Z)) C42H82NO8P DMEBDXIQFIKNQR-OIJJMQLXSA-N -BMDB07880 757.562155053 PC(14:0/20:2(11Z,14Z)) C42H80NO8P IRYMXEVDAKMFIF-YBLKGUNISA-N -BMDB07882 755.546504989 PC(14:0/20:3(8Z,11Z,14Z)) C42H78NO8P ZAUFLMLTXNKVAB-AFYHZPHLSA-N -BMDB07883 753.530854925 PC(14:0/20:4(5Z,8Z,11Z,14Z)) C42H76NO8P SRQSAJRUMDQMMS-NLDJLLEISA-N -BMDB07886 789.624755309 PC(14:0/22:0) C44H88NO8P KNQNJCODLDRFSM-HUESYALOSA-N -BMDB07887 787.609105245 PC(14:0/22:1(13Z)) C44H86NO8P LOVKBDFNFACEND-HSEDGGQWSA-N -BMDB07889 781.562155053 PC(14:0/22:4(7Z,10Z,13Z,16Z)) C44H80NO8P UDOCLKXJVMJFLD-CCHOKCMJSA-N -BMDB07891 779.546504989 PC(14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C44H78NO8P SFEMWZZGMMRGCX-DYPKKMQZSA-N -BMDB07899 675.483904733 PC(14:1(9Z)/14:0) C36H70NO8P XQPYHFHTTVXZKL-XBEBLRSGSA-N -BMDB07902 703.515204861 PC(14:1(9Z)/16:0) C38H74NO8P ANKCYRKQDLQXGL-MRDDHZETSA-N -BMDB07904 731.546504989 PC(14:1(9Z)/18:0) C40H78NO8P USMRUWLOXQOAAX-IUXSEFJDSA-N -BMDB07906 729.530854925 PC(14:1(9Z)/18:1(9Z)) C40H76NO8P KFGSHFVDCHWRGE-LULHKCDZSA-N -BMDB07907 727.515204861 PC(14:1(9Z)/18:2(9Z,12Z)) C40H74NO8P FLXFESILEUFIBE-SHAXIEEXSA-N -BMDB07911 759.577805117 PC(14:1(9Z)/20:0) C42H82NO8P SJLGFZBXPQKJIH-LLVYEJTBSA-N -BMDB07912 757.562155053 PC(14:1(9Z)/20:1(11Z)) C42H80NO8P OLUKQTJCNPHKRC-LYJZGNKWSA-N -BMDB07913 755.546504989 PC(14:1(9Z)/20:2(11Z,14Z)) C42H78NO8P KBHCBANQRIOXLD-FRPVHTQQSA-N -BMDB07915 753.530854925 PC(14:1(9Z)/20:3(8Z,11Z,14Z)) C42H76NO8P MGHZJKXUBUUNJR-PCBJBAEXSA-N -BMDB07919 787.609105245 PC(14:1(9Z)/22:0) C44H86NO8P OSTGKIDWKPXCRQ-FASREOMLSA-N -BMDB07920 785.593455181 PC(14:1(9Z)/22:1(13Z)) C44H84NO8P CGXBWJDAGMQUFG-MHJIJCEHSA-N -BMDB07922 779.546504989 PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C44H78NO8P XBLSNYPBWMKQLW-WPNBCRARSA-N -BMDB07932 691.515204861 PC(15:0/14:0) C37H74NO8P NRUYJKRRJLLXGF-PGUFJCEWSA-N -BMDB07934 705.530854925 PC(15:0/15:0) C38H76NO8P LJARBVLDSOWRJT-PSXMRANNSA-N -BMDB07935 719.546504989 PC(15:0/16:0) C39H78NO8P LLHISNQVRRYJGL-DIPNUNPCSA-N -BMDB07936 717.530854925 PC(15:0/16:1(9Z)) C39H76NO8P QFVHCMLUKNHDSH-WTWBAFHPSA-N -BMDB07937 747.577805117 PC(15:0/18:0) C41H82NO8P SKPMPGXBXHJZPS-LDLOPFEMSA-N -BMDB07939 745.562155053 PC(15:0/18:1(9Z)) C41H80NO8P ZEWLMKXMNQOCOQ-KUNNKMQBSA-N -BMDB07940 743.546504989 PC(15:0/18:2(9Z,12Z)) C41H78NO8P DGBYUHHIADYUMU-UESLNCBNSA-N -BMDB07944 775.609105245 PC(15:0/20:0) C43H86NO8P OUQNLKQTFDIKCN-VQJSHJPSSA-N -BMDB07945 773.593455181 PC(15:0/20:1(11Z)) C43H84NO8P TYQXQGGTOWQUKL-HFWGUVFESA-N -BMDB07946 771.577805117 PC(15:0/20:2(11Z,14Z)) C43H82NO8P XSSUJRSOHXBICQ-GPDPEMMZSA-N -BMDB07948 769.562155053 PC(15:0/20:3(8Z,11Z,14Z)) C43H80NO8P ILVRORZGIYNHIC-XWIBIVISSA-N -BMDB07953 803.640405373 PC(15:0/22:0) C45H90NO8P QIDZFMDALJEYDR-VZUYHUTRSA-N -BMDB07965 705.530854925 PC(16:0/14:0) C38H76NO8P UIXXHROAQSBBOV-PSXMRANNSA-N -BMDB07966 703.515204861 PC(16:0/14:1(9Z)) C38H74NO8P XIVQWQSVYQCUSU-MRDDHZETSA-N -BMDB07967 719.546504989 PC(16:0/15:0) C39H78NO8P NPGWXTIWUUFYAB-DIPNUNPCSA-N -BMDB07969 731.546504989 PC(16:0/16:1(9Z)) C40H78NO8P QIBZFHLFHCIUOT-NPBIGWJUSA-N -BMDB07970 761.593455181 PC(16:0/18:0) C42H84NO8P PZNPLUBHRSSFHT-RRHRGVEJSA-N -BMDB07972 759.577805117 PC(16:0/18:1(9Z)) C42H82NO8P WTJKGGKOPKCXLL-VYOBOKEXSA-N -BMDB07973 757.562155053 PC(16:0/18:2(9Z,12Z)) C42H80NO8P JLPULHDHAOZNQI-ZTIMHPMXSA-N -BMDB07974 755.546504989 PC(16:0/18:3(6Z,9Z,12Z)) C42H78NO8P CNNSEHUKQJCGTE-UPPWDXJYSA-N -BMDB07975 755.546504989 PC(16:0/18:3(9Z,12Z,15Z)) C42H78NO8P JMAYDGBZRHQJAT-QWFQJEORSA-N -BMDB07976 753.530854925 PC(16:0/18:4(6Z,9Z,12Z,15Z)) C42H76NO8P USCDCOXUROEQQA-ZPWYYLPXSA-N -BMDB07977 789.624755309 PC(16:0/20:0) C44H88NO8P HVPURDWMANOTFO-HUESYALOSA-N -BMDB07978 787.609105245 PC(16:0/20:1(11Z)) C44H86NO8P MZZHKIPFYPOYKP-NYJULOOZSA-N -BMDB07979 785.593455181 PC(16:0/20:2(11Z,14Z)) C44H84NO8P ZRTZULWIAWDUBY-UXSLIEDSSA-N -BMDB07981 783.577805117 PC(16:0/20:3(8Z,11Z,14Z)) C44H82NO8P SRIGHEHXEGELQJ-YYQUKWHJSA-N -BMDB07982 781.562155053 PC(16:0/20:4(5Z,8Z,11Z,14Z)) C44H80NO8P IIZPXYDJLKNOIY-JXPKJXOSSA-N -BMDB07984 779.546504989 PC(16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C44H78NO8P KLTHQSWIRFFBRI-CPFPVJFHSA-N -BMDB07988 809.593455181 PC(16:0/22:4(7Z,10Z,13Z,16Z)) C46H84NO8P IRWRFKUTKSUFST-MDYGELLQSA-N -BMDB07990 807.577805117 PC(16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C46H82NO8P ARDJUHDXABDVFH-ZHSIBHBUSA-N -BMDB07991 805.562155053 PC(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H80NO8P IESVDEZGAHUQJU-ZLBXKVHBSA-N -BMDB07998 703.515204861 PC(16:1(9Z)/14:0) C38H74NO8P RHCWZMAZVBVICJ-IZNHTBNISA-N -BMDB08000 717.530854925 PC(16:1(9Z)/15:0) C39H76NO8P DZDGAJVMZIHSLH-WTWBAFHPSA-N -BMDB08001 731.546504989 PC(16:1(9Z)/16:0) C40H78NO8P IPMVHVDAYPUFKH-WYRBGLKBSA-N -BMDB08002 729.530854925 PC(16:1(9Z)/16:1(9Z)) C40H76NO8P GPWHCUUIQMGELX-VHQDNGOZSA-N -BMDB08003 759.577805117 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-BMDB08271 811.609105245 PC(20:0/18:3(6Z,9Z,12Z)) C46H86NO8P DLZPSAPMHALIOA-YNCVDBFYSA-N -BMDB08272 811.609105245 PC(20:0/18:3(9Z,12Z,15Z)) C46H86NO8P ZDCCXTFOQDDLSE-LITWNLNFSA-N -BMDB08273 809.593455181 PC(20:0/18:4(6Z,9Z,12Z,15Z)) C46H84NO8P UELRKDJVEHFVAI-QZOXBMLCSA-N -BMDB08276 841.656055437 PC(20:0/20:2(11Z,14Z)) C48H92NO8P DGKXFLANAYRYMU-BYZVZMPQSA-N -BMDB08278 839.640405373 PC(20:0/20:3(8Z,11Z,14Z)) C48H90NO8P BRHVVSCMXSBYAI-XXXCGRBJSA-N -BMDB08279 837.624755309 PC(20:0/20:4(5Z,8Z,11Z,14Z)) C48H88NO8P UAVRPIXHIHJERN-CBTSKTMBSA-N -BMDB08290 899.734305757 PC(20:0/24:1(15Z)) C52H102NO8P JAMSDVDUWQNQFZ-QNQJCTKXSA-N -BMDB08295 759.577805117 PC(20:1(11Z)/14:0) C42H82NO8P WSBNPWBHAOQZJF-OIJJMQLXSA-N -BMDB08296 757.562155053 PC(20:1(11Z)/14:1(9Z)) C42H80NO8P FMLFVZOURBVUJL-LYJZGNKWSA-N -BMDB08297 773.593455181 PC(20:1(11Z)/15:0) C43H84NO8P VATZLDBYQIOABD-HFWGUVFESA-N -BMDB08298 787.609105245 PC(20:1(11Z)/16:0) C44H86NO8P RLIWKVWRUOJIHW-NYJULOOZSA-N -BMDB08299 785.593455181 PC(20:1(11Z)/16:1(9Z)) C44H84NO8P NZMJAZKGUFCMTN-NPCYKUJHSA-N -BMDB08302 813.624755309 PC(20:1(11Z)/18:1(9Z)) C46H88NO8P QLEJPADMSQQACL-WWUFLCHTSA-N -BMDB08303 811.609105245 PC(20:1(11Z)/18:2(9Z,12Z)) C46H86NO8P KJDCENXZHMAYTN-VHWCKNCUSA-N -BMDB08304 809.593455181 PC(20:1(11Z)/18:3(6Z,9Z,12Z)) C46H84NO8P FHOBLZOUZRDCHR-VSYNYFESSA-N -BMDB08305 809.593455181 PC(20:1(11Z)/18:3(9Z,12Z,15Z)) C46H84NO8P NOWQIXJSMOBJLS-LMJTUUMUSA-N -BMDB08306 807.577805117 PC(20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C46H82NO8P YDPVXGLBOPTMBY-SNMLGIRPSA-N -BMDB08308 841.656055437 PC(20:1(11Z)/20:1(11Z)) C48H92NO8P AEUCYCQYAUFAKH-DITNKEBASA-N -BMDB08309 839.640405373 PC(20:1(11Z)/20:2(11Z,14Z)) C48H90NO8P ZGKPOUQXLZVCDF-GPPISGLTSA-N -BMDB08311 837.624755309 PC(20:1(11Z)/20:3(8Z,11Z,14Z)) C48H88NO8P QLESDNGWICTNRJ-ONITYOGDSA-N -BMDB08328 757.562155053 PC(20:2(11Z,14Z)/14:0) C42H80NO8P JFWZYNWHJJSDAY-YBLKGUNISA-N -BMDB08329 755.546504989 PC(20:2(11Z,14Z)/14:1(9Z)) C42H78NO8P MYWHURBVYAKZKD-FRPVHTQQSA-N -BMDB08330 771.577805117 PC(20:2(11Z,14Z)/15:0) C43H82NO8P LNGBVAOHJZCRIL-GPDPEMMZSA-N -BMDB08331 785.593455181 PC(20:2(11Z,14Z)/16:0) C44H84NO8P JCABAGPMEUGRDK-UXSLIEDSSA-N -BMDB08332 783.577805117 PC(20:2(11Z,14Z)/16:1(9Z)) C44H82NO8P VPDVXUMWNZFISL-ZAEMQJNLSA-N -BMDB08333 813.624755309 PC(20:2(11Z,14Z)/18:0) C46H88NO8P BRSRLMBMUIZSFE-UHKGRJRRSA-N -BMDB08335 811.609105245 PC(20:2(11Z,14Z)/18:1(9Z)) C46H86NO8P YULWBFNKMAKVNZ-UETRTARBSA-N -BMDB08336 809.593455181 PC(20:2(11Z,14Z)/18:2(9Z,12Z)) C46H84NO8P ZPAYLLVKQCNXOK-JEHIXBSSSA-N -BMDB08337 807.577805117 PC(20:2(11Z,14Z)/18:3(6Z,9Z,12Z)) C46H82NO8P WTLVSDIWQGLEAN-MFMUPFOOSA-N -BMDB08338 807.577805117 PC(20:2(11Z,14Z)/18:3(9Z,12Z,15Z)) C46H82NO8P ZWBUMNLEWHYPRH-HTEBOPLQSA-N -BMDB08339 805.562155053 PC(20:2(11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C46H80NO8P DMULDNPMYQMFAE-YCAHXJLUSA-N -BMDB08340 841.656055437 PC(20:2(11Z,14Z)/20:0) C48H92NO8P BVDPROLNIRIVET-SZAAGBBJSA-N -BMDB08341 839.640405373 PC(20:2(11Z,14Z)/20:1(11Z)) C48H90NO8P VSWBEFJQWZEWPT-KWPMQJQMSA-N -BMDB08342 837.624755309 PC(20:2(11Z,14Z)/20:2(11Z,14Z)) C48H88NO8P AAYOXXRTLLISDA-RCXGQNHQSA-N -BMDB08394 755.546504989 PC(20:3(8Z,11Z,14Z)/14:0) C42H78NO8P VKVSSDKCKXJFIM-AFYHZPHLSA-N -BMDB08395 753.530854925 PC(20:3(8Z,11Z,14Z)/14:1(9Z)) C42H76NO8P UGOXZVQDVQJYIN-PCBJBAEXSA-N -BMDB08396 769.562155053 PC(20:3(8Z,11Z,14Z)/15:0) C43H80NO8P PBYSSMVZTSQJLK-XWIBIVISSA-N -BMDB08397 783.577805117 PC(20:3(8Z,11Z,14Z)/16:0) C44H82NO8P YKSVDDIMSQYNID-YYQUKWHJSA-N -BMDB08398 781.562155053 PC(20:3(8Z,11Z,14Z)/16:1(9Z)) C44H80NO8P SMNBWWUNQGASFC-MLQXCARSSA-N -BMDB08399 811.609105245 PC(20:3(8Z,11Z,14Z)/18:0) C46H86NO8P UTVPIFAQLMVRBR-DXLHFBPTSA-N -BMDB08401 809.593455181 PC(20:3(8Z,11Z,14Z)/18:1(9Z)) C46H84NO8P SLKDYSINLYWLQQ-IGMUWBMCSA-N -BMDB08402 807.577805117 PC(20:3(8Z,11Z,14Z)/18:2(9Z,12Z)) C46H82NO8P SUACBSWYGWBPFC-GPUJSUHJSA-N -BMDB08403 805.562155053 PC(20:3(8Z,11Z,14Z)/18:3(6Z,9Z,12Z)) C46H80NO8P RIDIYDAFPMEWTP-AFNUAFPGSA-N -BMDB08404 805.562155053 PC(20:3(8Z,11Z,14Z)/18:3(9Z,12Z,15Z)) C46H80NO8P ONHNZXQSGXKTJD-FKOQMNRQSA-N -BMDB08406 839.640405373 PC(20:3(8Z,11Z,14Z)/20:0) C48H90NO8P NMVCKDUPYAOXCG-XGEOKNOUSA-N -BMDB08426 753.530854925 PC(20:4(5Z,8Z,11Z,14Z)/14:0) C42H76NO8P KMZWZYBLPBQHMP-PVHGPNMRSA-N -BMDB08429 781.562155053 PC(20:4(5Z,8Z,11Z,14Z)/16:0) C44H80NO8P PUDHBQQGURLBGJ-IVFHWKNFSA-N -BMDB08430 779.546504989 PC(20:4(5Z,8Z,11Z,14Z)/16:1(9Z)) C44H78NO8P KKRYRHYMXROGPM-SOVKMKKSSA-N -BMDB08431 809.593455181 PC(20:4(5Z,8Z,11Z,14Z)/18:0) C46H84NO8P DNYKSJQVBCVGOF-LCKGXUDJSA-N -BMDB08433 807.577805117 PC(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) C46H82NO8P PJAVLQZDHFXHPI-IHBLHBMHSA-N -BMDB08434 805.562155053 PC(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)) C46H80NO8P PLZBTDKJYHXIEW-DZUXOTHRSA-N -BMDB08438 837.624755309 PC(20:4(5Z,8Z,11Z,14Z)/20:0) C48H88NO8P DXCCGBCVYMELBT-NDJZOZGISA-N -BMDB08495 779.546504989 PC(20:5(5Z,8Z,11Z,14Z,17Z)/16:0) C44H78NO8P SUZYROYNFNQALJ-MHEIZRSESA-N -BMDB08497 807.577805117 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:0) C46H82NO8P JKDOKILDEIEPFZ-LGPFJNBISA-N -BMDB08499 805.562155053 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)) C46H80NO8P JZKMYCPNBSRARO-YMBRLFDISA-N -BMDB08525 789.624755309 PC(22:0/14:0) C44H88NO8P JFNNIQMJYCUZKY-HUESYALOSA-N -BMDB08526 787.609105245 PC(22:0/14:1(9Z)) C44H86NO8P RGHFEAMZDBFLPO-FASREOMLSA-N -BMDB08527 803.640405373 PC(22:0/15:0) C45H90NO8P AAQYYLOZSPSSEX-VZUYHUTRSA-N -BMDB08533 841.656055437 PC(22:0/18:2(9Z,12Z)) C48H92NO8P LDQMGTRKTWSKIW-QGXZLJJESA-N -BMDB08534 839.640405373 PC(22:0/18:3(6Z,9Z,12Z)) C48H90NO8P OFWRYSQDJOQSHU-FARFQYTLSA-N -BMDB08535 839.640405373 PC(22:0/18:3(9Z,12Z,15Z)) C48H90NO8P JYFWSVLYQSTYHE-NOAWTOFZSA-N -BMDB08536 837.624755309 PC(22:0/18:4(6Z,9Z,12Z,15Z)) C48H88NO8P LFDYHYAWJHIDTQ-GFEYAWDCSA-N -BMDB08546 899.734305757 PC(22:0/22:1(13Z)) C52H102NO8P LTXUEXPDKWPLQA-ZMGYLBOHSA-N -BMDB08553 927.765605885 PC(22:0/24:1(15Z)) C54H106NO8P YVOMCNAZZLQFGN-BJHYVVJGSA-N -BMDB08558 787.609105245 PC(22:1(13Z)/14:0) C44H86NO8P RSKUBXWDAIDNLE-HSEDGGQWSA-N -BMDB08559 785.593455181 PC(22:1(13Z)/14:1(9Z)) C44H84NO8P CYQUGAJGPGKDFF-MHJIJCEHSA-N -BMDB08564 841.656055437 PC(22:1(13Z)/18:1(9Z)) C48H92NO8P CZZWUVSNBSTVTM-ACZCORRTSA-N -BMDB08565 839.640405373 PC(22:1(13Z)/18:2(9Z,12Z)) C48H90NO8P QITWVLBMWWSFPO-PUXNAPJVSA-N -BMDB08566 837.624755309 PC(22:1(13Z)/18:3(6Z,9Z,12Z)) C48H88NO8P BUYWHDOUDGEIHW-YEHISXKXSA-N -BMDB08567 837.624755309 PC(22:1(13Z)/18:3(9Z,12Z,15Z)) C48H88NO8P FHUAYOMRHXZKHT-JUGJLYODSA-N -BMDB08623 781.562155053 PC(22:4(7Z,10Z,13Z,16Z)/14:0) C44H80NO8P FHBLNLYBVANDFG-CCHOKCMJSA-N -BMDB08624 779.546504989 PC(22:4(7Z,10Z,13Z,16Z)/14:1(9Z)) C44H78NO8P UJZMLLMWTJZZJX-WPNBCRARSA-N -BMDB08626 809.593455181 PC(22:4(7Z,10Z,13Z,16Z)/16:0) C46H84NO8P LKZIWAABXRQNGG-JAYRDFRFSA-N -BMDB08627 807.577805117 PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) C46H82NO8P STHWQCYHQJBDDB-SYONOARRSA-N -BMDB08628 837.624755309 PC(22:4(7Z,10Z,13Z,16Z)/18:0) C48H88NO8P YVFBVKJWPMCQQG-NRICRUJBSA-N -BMDB08689 779.546504989 PC(22:5(7Z,10Z,13Z,16Z,19Z)/14:0) C44H78NO8P LPZVTJRCWZIDNE-DYPKKMQZSA-N -BMDB08725 805.562155053 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0) C46H80NO8P YALZVLCVXOASDL-FZGNBNATSA-N -BMDB08768 899.734305757 PC(24:0/20:1(11Z)) C52H102NO8P FPTZGKMFUCCQES-ZMGYLBOHSA-N -BMDB08792 841.656055437 PC(24:1(15Z)/16:1(9Z)) C48H92NO8P ZHHDWDXQYDFYKQ-QYQAGSNQSA-N -BMDB10381 481.316839407 LysoPC(15:0) C23H48NO7P RJZVWDTYEWCUAR-JOCHJYFZSA-N -BMDB10382 495.332489471 LysoPC(16:0) C24H50NO7P ASWBNKHCZGQVJV-HSZRJFAPSA-N -BMDB10386 519.332489471 LysoPC(18:2(9Z,12Z)) C26H50NO7P SPJFYYJXNPEZDW-FTJOPAKQSA-N -BMDB10411 778.70504074 TG(16:0/14:0/16:0)[iso3] C49H94O6 NSQZMMPMMBEIIA-UHFFFAOYSA-N -BMDB10412 776.689390676 TG(16:0/14:0/16:1(9Z))[iso6] C49H92O6 VUYXIQLBLBPRDY-FIZKWYBOSA-N -BMDB10413 806.736340868 TG(16:0/14:0/18:0)[iso6] C51H98O6 HVGKTEKOBPKGTR-QSCHNALKSA-N -BMDB10414 804.720690804 TG(16:0/14:0/18:1(9Z))[iso6] C51H96O6 OXKCYPBFNOPGNR-FOBNYNKYSA-N -BMDB10416 832.751990932 TG(16:0/16:0/18:1(11Z))[iso3] C53H100O6 ZKEWGTVAIGJNBK-VLBIAFCBSA-N -BMDB10417 828.720690804 TG(16:0/16:0/18:3(9Z,12Z,15Z))[iso3] C53H96O6 WLFXGZDFDKIDIL-AVVZNEQPSA-N -BMDB10418 878.736340868 TG(16:0/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3] C57H98O6 GNADFLWMYUNMMR-RWKYOVKRSA-N -BMDB10423 830.736340868 TG(16:1(9Z)/16:0/18:1(11Z))[iso6] C53H98O6 TVENQJOAVIJNCV-WMKGZJNJSA-N -BMDB10424 826.70504074 TG(16:1(9Z)/16:0/18:3(9Z,12Z,15Z))[iso6] C53H94O6 LCCSSJALYOQLAY-PXKDUDJKSA-N -BMDB10425 858.767640996 TG(16:1(9Z)/18:0/18:1(11Z))[iso6] C55H102O6 QOKAQJJBGBHKQF-BHSMRSOWSA-N -BMDB10426 804.720690804 TG(18:0/14:0/16:1(9Z))[iso6] C51H96O6 GDRDGFOLBPNIBE-XSIURGGPSA-N -BMDB10427 834.767640996 TG(18:0/14:0/18:0)[iso3] C53H102O6 MARPCPMDFOPPJX-UHFFFAOYSA-N -BMDB10428 832.751990932 TG(18:0/14:0/18:1(11Z))[iso6] C53H100O6 MITUBFKADCJAMS-ZMSSUMMHSA-N -BMDB10429 832.751990932 TG(18:0/14:0/18:1(9Z))[iso6] C53H100O6 IFVQPZDHFMEHAS-YVUYSCDNSA-N -BMDB10430 830.736340868 TG(18:0/14:0/18:2(9Z,12Z))[iso6] C53H98O6 ODCBLKWKYWYBIY-TUVYQMNMSA-N -BMDB10431 860.78329106 TG(18:0/16:0/18:1(11Z))[iso6] C55H104O6 XWOGDCXWTYZPKJ-QCSIWSIHSA-N -BMDB10434 830.736340868 TG(18:1(11Z)/14:0/18:1(11Z))[iso3] C53H98O6 KSDAXSHCJFDETR-IKJQKJQYSA-N -BMDB10435 830.736340868 TG(18:1(11Z)/14:0/18:1(9Z))[iso6] C53H98O6 FYLBINGMERYUTQ-MSOJSNCQSA-N -BMDB10437 858.767640996 TG(18:1(11Z)/16:0/18:1(11Z))[iso3] C55H102O6 SFJDWDOXOLBSHJ-IKJQKJQYSA-N -BMDB10438 858.767640996 TG(18:1(11Z)/16:0/18:1(9Z))[iso6] C55H102O6 HYQDVSFOHNVBHQ-RXBOFXCQSA-N -BMDB10441 880.751990932 TG(18:1(11Z)/16:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H100O6 MZKZFZRBZNYKEI-JHELZGSHSA-N -BMDB10448 830.736340868 TG(18:1(9Z)/14:0/18:1(9Z))[iso3] C53H98O6 DDNSMJIEBXEPOS-DSOYXUETSA-N -BMDB10453 878.736340868 TG(18:1(9Z)/16:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H98O6 QFWRCXUOTZVILC-UHMKBKRGSA-N -BMDB10454 906.767640996 TG(18:1(9Z)/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 FMWBJEAEGFGGAB-URMSEKCYSA-N -BMDB10459 880.751990932 TG(18:1(9Z)/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C57H100O6 GOEUQPTVSLNGLY-SIPJYBKGSA-N -BMDB10460 880.751990932 TG(18:1(9Z)/18:1(9Z)/18:3(9Z,12Z,15Z))[iso3] C57H100O6 OEJXMJPFOHYSIU-GRLFFVHSSA-N -BMDB10466 940.845891316 TG(18:1(9Z)/18:1(9Z)/22:1(13Z))[iso3] C61H112O6 TUJAWJCRCOOMQU-MPSDTBBVSA-N -BMDB10470 826.70504074 TG(18:2(9Z,12Z)/14:0/18:2(9Z,12Z))[iso3] C53H94O6 JZVVUGYNBNZRQI-ZBTSZJFVSA-N -BMDB10472 850.70504074 TG(18:2(9Z,12Z)/14:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H94O6 HQPWVNCYCOACEY-OAXWTFOCSA-N -BMDB10475 876.720690804 TG(18:2(9Z,12Z)/16:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H96O6 ABKREXPZUFOPCM-ZKSUYQBGSA-N -BMDB10477 880.751990932 TG(18:2(9Z,12Z)/18:0/18:3(9Z,12Z,15Z))[iso6] C57H100O6 RRAQCLWYZXSZBE-ATHBHBQWSA-N -BMDB10479 880.751990932 TG(18:2(9Z,12Z)/18:1(11Z)/18:2(9Z,12Z))[iso3] C57H100O6 YJBUODNAHDVYLJ-LNZLXKATSA-N -BMDB10481 878.736340868 TG(18:2(9Z,12Z)/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C57H98O6 JEUSYMMQMCKJOY-YHOLSIJASA-N -BMDB10482 878.736340868 TG(18:2(9Z,12Z)/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C57H98O6 POGJAUDNOWLVNS-GTFIAHEWSA-N -BMDB10485 906.767640996 TG(18:2(9Z,12Z)/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C59H102O6 BAYJGANIIKHKCP-JKEXLARWSA-N -BMDB10489 876.720690804 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/18:3(6Z,9Z,12Z))[iso3] C57H96O6 GBDGUGNAHCFRDF-HCMATFEHSA-N -BMDB10490 876.720690804 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))[iso3] C57H96O6 NGPHUAVENUDDAO-VFDREBADSA-N -BMDB10491 906.767640996 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/20:2(11Z,14Z))[iso3] C59H102O6 ZTNDRFCABXFVMY-WJTCTALZSA-N -BMDB10499 850.70504074 TG(18:3(9Z,12Z,15Z)/16:0/18:3(9Z,12Z,15Z))[iso3] C55H94O6 RHWAKRNYKAWEPQ-HTINPRBKSA-N -BMDB10501 878.736340868 TG(18:3(9Z,12Z,15Z)/18:0/18:3(9Z,12Z,15Z))[iso3] C57H98O6 YNIUACHBBNUDCJ-AEIMPNQHSA-N -BMDB10502 876.720690804 TG(18:3(9Z,12Z,15Z)/18:1(11Z)/18:3(9Z,12Z,15Z))[iso3] C57H96O6 XAPLGDBVXAOWFP-MLQCFMLMSA-N -BMDB10503 876.720690804 TG(18:3(9Z,12Z,15Z)/18:1(9Z)/18:3(9Z,12Z,15Z))[iso3] C57H96O6 NVWCWIVBYYFJGP-NVKSNHTESA-N -BMDB10519 876.720690804 TG(20:4(5Z,8Z,11Z,14Z)/16:0/18:3(9Z,12Z,15Z))[iso6] C57H96O6 OREFSGWJXDJEBG-VJKJLHIWSA-N -BMDB10710 755.627518701 "Galactosylceramide (d18:1/20:0) " C44H85NO8 DFELABABMXOKTD-RBULGSFCSA-N -BMDB11128 523.363789599 LysoPC(0:0/18:0) C26H54NO7P IQGPMZRCLCCXAG-RUZDIDTESA-N -BMDB11151 743.582890495 PC(O-16:0/18:2(9Z,12Z)) C42H82NO7P IQACMFWAGALEAQ-WESJWMGVSA-N -BMDB11163 248.064450748 "L-beta-aspartyl-L-aspartic acid " C8H12N2O7 KXAWLANLJYMEGB-UHFFFAOYSA-N -BMDB11165 190.05897144 "L-beta-aspartyl-L-glycine " C6H10N2O5 ZTEDWFWBGPKUOD-UHFFFAOYSA-N -BMDB11174 228.147392516 "L-isoleucyl-L-proline " C11H20N2O3 BBIXOODYWPFNDT-UHFFFAOYSA-N -BMDB11175 228.147392516 "L-leucyl-L-proline " C11H20N2O3 VTJUNIYRYIAIHF-UHFFFAOYSA-N -BMDB11177 262.131742452 "L-phenylalanyl-L-proline " C14H18N2O3 WEQJQNWXCSUVMA-UHFFFAOYSA-N -BMDB11180 212.116092388 "L-prolyl-L-proline " C10H16N2O3 RWCOTTLHDJWHRS-UHFFFAOYSA-N -BMDB11201 837.624755309 PC(20:3(8Z,11Z,14Z)/20:1(11Z)) C48H88NO8P LZXZOHSYOCWXFB-DWTYVZKUSA-N -BMDB11420 747.520290239 PE(P-18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C43H74NO7P RDLRIZLZWSNORN-FSOAWXQVSA-N -BMDB11635 172.019414812 "p-Cresol sulfate" C7H8O3S JOXIMZWYDAKGHI-UHFFFAOYSA-N -BMDB11700 844.751990932 TG(15:0/16:0/20:2(11Z,14Z))[iso6] C54H100O6 VVCOWDFFHRITHU-AMOPXLHCSA-N -BMDB11701 842.736340868 TG(15:0/16:0/20:3(8Z,11Z,14Z))[iso6] C54H98O6 NVBSJAZGISYRIW-TYTGEOLTSA-N -BMDB11702 840.720690804 TG(15:0/16:0/20:4(5Z,8Z,11Z,14Z))[iso6] C54H96O6 LVHOHHSODZICOO-WWFLFYERSA-N -BMDB11703 844.751990932 TG(15:0/18:0/18:2(9Z,12Z))[iso6] C54H100O6 HRJZTBUCFKIMBE-TXWVTNJISA-N -BMDB11704 842.736340868 TG(15:0/18:0/18:3(9Z,12Z,15Z))[iso6] C54H98O6 QELMLHKKGIZABI-ZCTUBHHNSA-N -BMDB11705 818.736340868 TG(15:0/18:1(9Z)/16:0)[iso6] C52H98O6 BSQPTNJXCHRJSC-WURLXDQTSA-N -BMDB11707 844.751990932 TG(15:0/18:1(9Z)/18:1(9Z))[iso3] C54H100O6 AWIUIZBTCDJMSM-JGORSHKTSA-N -BMDB11708 842.736340868 TG(15:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C54H98O6 AFUGNQFGFOCTMS-GBFVOJRPSA-N -BMDB11709 840.720690804 TG(15:0/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C54H96O6 AKXOSLAHFAWDCG-KQCPJNLHSA-N -BMDB11711 840.720690804 TG(15:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C54H96O6 MIHLTJZHRJACQQ-QORKGRBZSA-N -BMDB11712 818.736340868 TG(15:0/20:0/14:1(9Z))[iso6] C52H98O6 OYJCGTSOIVQMIE-GFFYSNCTSA-N -BMDB11713 818.736340868 TG(15:0/20:1(11Z)/14:0)[iso6] C52H98O6 LJWLZNNKGFHCMA-AHTWSVOLSA-N -BMDB11723 193.073893223 "2-Methylhippuric acid" C10H11NO3 YOEBAVRJHRCKRE-UHFFFAOYSA-N -BMDB11733 132.053492132 Glycyl-glycine C4H8N2O3 YMAWOPBAYDPSLA-UHFFFAOYSA-N -BMDB11760 539.527745079 Cer(d18:0/16:0) C34H69NO3 GCGTXOVNNFGTPQ-JHOUSYSJSA-N -BMDB11766 621.605995399 Cer(d18:0/22:1(13Z)) C40H79NO3 AOHMXFJFQLUIJL-RDUWXOKWSA-N -BMDB11769 649.637295527 Cer(d18:0/24:1(15Z)) C42H83NO3 YUULKFVZRXQHPM-ATHUGRIKSA-N -BMDB12089 730.59887491 SM(d18:0/18:1(9Z)) C41H83N2O6P XYLWKHKCYHMVMA-RVPJYPCXSA-N -BMDB12095 814.692775294 SM(d18:0/24:1(15Z)) C47H95N2O6P XZBDYCJQWJNNJB-CFLZVKAOSA-N -BMDB12133 108.021129372 1,2-Benzoquinone C6H4O2 WOAHJDHKFWSLKE-UHFFFAOYSA-N -BMDB12275 121.089149357 Phenylethylamine C8H11N BHHGXPLMPWCGHP-UHFFFAOYSA-N -BMDB12305 550.060105754 UDP-L-rhamnose C15H24N2O16P2 DRDCJEIZVLVWNC-SLBWPEPYSA-N -BMDB12328 254.224580204 "Palmitelaidic acid" C16H30O2 SECPZKHBENQXJG-BQYQJAHWSA-N -BMDB12971 102.10446507 1-Hexanol C6H14O ZSIAUFGUXNUGDI-UHFFFAOYSA-N -BMDB13025 355.263705364 "6,9,12,15,18,21-Tetracosahexaenoic acid" C24H35O2 YHGJECVSSKXFCJ-SFGLVEFQSA-M -BMDB13036 88.088815006 1-Pentanol C5H12O AMQJEAYHLZJPGS-UHFFFAOYSA-N -BMDB13127 247.141972787 Hydroxybutyrylcarnitine C11H21NO5 UEFRDQSMQXDWTO-GKAPJAKFSA-N -BMDB13128 245.162708229 Valerylcarnitine C12H23NO4 VSNFQQXVMPSASB-JTQLQIEISA-N -BMDB13326 341.256608611 trans-2-Dodecenoylcarnitine C19H35NO4 JEOZLTJHDSKQIT-CLVCIHKQSA-N -BMDB13341 691.551590367 PC(o-14:0/16:0) C38H78NO7P BYMZZQJJOHDZOU-DIPNUNPCSA-N -BMDB13404 717.567240431 PC(o-16:0/16:1(9Z)) C40H80NO7P HJVQHTGUAIETCQ-VEAYGOGPSA-N -BMDB13405 747.614190623 PC(o-16:0/18:0) C42H86NO7P PXPSGTINXJQLBR-VQJSHJPSSA-N -BMDB13406 775.645490751 PC(o-16:0/20:0) C44H90NO7P QFZSBLJYDQLBAG-VZUYHUTRSA-N -BMDB13408 803.676790879 PC(o-16:0/22:0) C46H94NO7P BIIIEBBIUJYGBZ-WBVITSLISA-N -BMDB13412 745.598540559 PC(o-16:1(9Z)/18:0) C42H84NO7P SVSLBZPEDBYFGG-HVLKLTLRSA-N -BMDB13413 741.567240431 PC(o-16:1(9Z)/18:2(9Z,12Z)) C42H80NO7P AXCLECQLCBWNLZ-KZZBVOOISA-N -BMDB13414 773.629840687 PC(o-16:1(9Z)/20:0) C44H88NO7P NEMVGIRAGVGOLH-RPBJOJELSA-N -BMDB13417 775.645490751 PC(o-18:0/18:0) C44H90NO7P BKEDGKIMIUGHDV-VZUYHUTRSA-N -BMDB13418 771.614190623 PC(o-18:0/18:2(9Z,12Z)) C44H86NO7P LMGTVCKIUNTOEP-HJTCUGKVSA-N -BMDB13419 803.676790879 PC(o-18:0/20:0) C46H94NO7P BVCZSMAYNCVQDT-WBVITSLISA-N -BMDB13422 819.614190623 PC(o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C48H86NO7P QBZALASVZLFAHF-KYPHJRDXSA-N -BMDB13426 745.598540559 PC(o-18:1(9Z)/16:0) C42H84NO7P IQLHTKSHLGLPMG-HFWGUVFESA-N -BMDB13429 769.598540559 PC(o-18:1(9Z)/18:2(9Z,12Z)) C44H84NO7P MFZLAZYUXHHSIA-HVODBARTSA-N -BMDB13434 857.723741071 PC(o-18:1(9Z)/24:0) C50H100NO7P BSQIZOZBOXYNEW-WIEGMJJDSA-N -BMDB13435 767.582890495 PC(o-18:2(9Z,12Z)/18:2(9Z,12Z)) C44H82NO7P XCCONPVPHCCYNF-KPFPPAHTSA-N -BMDB13439 797.629840687 PC(o-20:0/18:3(6Z,9Z,12Z)) C46H88NO7P XHKFHCCQLHPBPZ-WKDUQDSSSA-N -BMDB13440 797.629840687 PC(o-20:0/18:3(9Z,12Z,15Z)) C46H88NO7P APWUUZRAVVATRC-GBRUYZQDSA-N -BMDB13447 857.723741071 PC(o-22:0/20:1(11Z)) C50H100NO7P XKPLZICHJPNOFR-WIEGMJJDSA-N -BMDB13453 879.708091007 PC(o-22:1(13Z)/22:3(10Z,13Z,16Z)) C52H98NO7P ADCPDRAGQLKVRI-DFPONBFASA-N -BMDB13455 879.708091007 PC(o-22:2(13Z,16Z)/22:2(13Z,16Z)) C52H98NO7P GCAMFMBVIXVYSA-VIVKCUGUSA-N -BMDB13460 879.708091007 PC(o-24:0/20:4(8Z,11Z,14Z,17Z)) C52H98NO7P AQJDGYZOTXPNFY-ZFRXABNDSA-N -BMDB13667 88.905847902 Yttrium Y VWQVUPCCIRVNHF-UHFFFAOYSA-N -BMDB13669 132.90544687 Cesium Cs TVFDJXOCXUVLDH-UHFFFAOYSA-N -BMDB13670 105.903483087 Palladium Pd KDLHZDBZIXYQEI-UHFFFAOYSA-N -BMDB13672 139.905434035 Cerium Ce GWXLDORMOJMVQZ-UHFFFAOYSA-N -BMDB13711 Lanthanum (H2O)nC3La2O9 AFCUGQOTNCVYSW-UHFFFAOYSA-H -BMDB13715 141.907718643 Neodymium Nd QEFYFXOXNSNQGX-UHFFFAOYSA-N -BMDB13719 186.955750787 Rhenium Re WUAPFZMCVAUBPE-UHFFFAOYSA-N -BMDB13724 239.943264977 Thallium ClTl GBECUEIQVRDUKB-UHFFFAOYSA-M -BMDB13780 125.963162262 "Dimethyl trisulfide" C2H6S3 YWHLKYXPLRWGSE-UHFFFAOYSA-N -BMDB14273 176.032087988 "Vitamin C" C6H8O6 CIWBSHSKHKDKBQ-JLAZNSOCSA-N -BMDB30028 130.099379692 "Ethyl isovalerate" C7H14O2 PPXUHEORWJQRHJ-UHFFFAOYSA-N -BMDB30058 102.068079564 "Ethyl propionate" C5H10O2 FKRCODPIKNYEAC-UHFFFAOYSA-N -BMDB30962 278.224580204 "Calendic acid" C18H30O2 DQGMPXYVZZCNDQ-KBPWROHVSA-N -BMDB31003 170.13067982 "9-Decenoic acid" C10H18O2 KHAVLLBUVKBTBG-UHFFFAOYSA-N -BMDB31206 86.073164942 Pentanal C5H10O HGBOYTHUEUWSSQ-UHFFFAOYSA-N -BMDB31217 88.0524295 "Ethyl acetate" C4H8O2 XEKOWRVHYACXOJ-UHFFFAOYSA-N -BMDB31243 72.057514878 2-Methylpropanal C4H8O AMIMRNSIRUDHCM-UHFFFAOYSA-N -BMDB31475 114.10446507 Heptanal C7H14O FXHGMKSSBGDXIY-UHFFFAOYSA-N -BMDB31511 116.083729628 "Diacetone alcohol" C6H12O2 SWXVUIWOUIDPGS-UHFFFAOYSA-N -BMDB31523 74.036779436 "Methyl acetate" C3H6O2 KXKVLQRXCPHEJC-UHFFFAOYSA-N -BMDB31526 86.073164942 (±)-2-Methylbutanal C5H10O BYGQBDHUGHBGMD-UHFFFAOYSA-N -BMDB31527 88.088815006 (S)-2-Methyl-1-butanol C5H12O QPRQEDXDYOZYLA-UHFFFAOYSA-N -BMDB31599 88.088815006 2-Pentanol C5H12O JYVLIDXNZAXMDK-UHFFFAOYSA-N -BMDB31605 86.073164942 1-Penten-3-ol C5H10O VHVMXWZXFBOANQ-UHFFFAOYSA-N -BMDB32449 112.125200512 1-Octene C8H16 KWKAKUADMBZCLK-UHFFFAOYSA-N -BMDB33890 102.068079564 "Methyl butyrate" C5H10O2 UUIQMZJEGPQKFD-UHFFFAOYSA-N -BMDB33908 116.120115134 (±)-2-Heptanol C7H16O CETWDUZRCINIHU-UHFFFAOYSA-N -BMDB34168 92.062600256 Toluene C7H8 YXFVVABEGXRONW-UHFFFAOYSA-N -BMDB34235 86.073164942 2-Pentanone C5H10O XNLICIUVMPYHGG-UHFFFAOYSA-N -BMDB34729 96.057514878 (E,E)-2,4-Hexadienal C6H8O BATOPAZDIZEVQF-IAROGAJJSA-N -BMDB35658 136.125200512 (-)-alpha-Pinene C10H16 GRWFGVWFFZKLTI-IUCAKERBSA-N -BMDB35915 126.10446507 Sulcatone C8H14O UHEPJGULSIKKTP-UHFFFAOYSA-N -BMDB36574 75.94414138 "Carbon disulfide" CS2 QGJOPFRUJISHPQ-UHFFFAOYSA-N -BMDB40253 88.0524295 "Propyl formate" C4H8O2 KFNNIILCVOLYIR-UHFFFAOYSA-N -BMDB40327 116.083729628 "Pentyl formate" C6H12O2 DIQMPQMYFZXDAX-UHFFFAOYSA-N -BMDB59835 142.135765198 Nonanal C9H18O GYHFUZHODSMOHU-UHFFFAOYSA-N -BMDB60038 268.240230268 "10Z-Heptadecenoic acid" C17H32O2 GDTXICBNEOEPAZ-FPLPWBNLSA-N -BMDB60039 306.255880332 "11,14,17-Eicosatrienoic acid" C20H34O2 AHANXAKGNAKFSK-PDBXOOCHSA-N -BMDB60102 304.240230268 Arachidonate C20H32O2 YZXBAPSDXZZRGB-DOFZRALJSA-N -BMDB61883 116.083729628 "Caproate (6:0)" C6H12O2 FUZZWVXGSFPDMH-UHFFFAOYSA-N -BMDB61885 86.109550448 3-Methylpentane C6H14 PFEOZHBOMNWTJB-UHFFFAOYSA-N -BMDB62034 100.088815006 3-Methyl-2-pentanone C6H12O UIHCLUNTQKBZGK-UHFFFAOYSA-N -BMDB62036 82.041864813 3-Methylfuran C5H6O KJRRQXYWFQKJIP-UHFFFAOYSA-N -BMDB62037 122.036779433 "Benzoic acid" C7H6O2 WPYMKLBDIGXBTP-UHFFFAOYSA-N -BMDB62038 150.104465071 Thymol C10H14O MGSRCZKZVOBKFT-UHFFFAOYSA-N -BMDB62039 118.074227574 "2,4-Diaminobutyric acid" C4H10N2O2 OGNSCSPNOLGXSM-UHFFFAOYSA-N -BMDB62040 425.350508997 Oleoylcarnitine C25H47NO4 ASTZXVSQSSBFOS-FRHQNKJESA-N -BMDB62041 385.113782505 Phosphatidylserine C13H24NO10P UNJJBGNPUUVVFQ-ZJUUUORDSA-N -BMDB62042 102.042927446 Cycloserine C3H6N2O2 DYDCUQKUCUHJBH-UWTATZPHSA-N -BMDB62043 138.008195224 Fosfomycin C3H7O4P YMDXZJFXQJVXBF-STHAYSLISA-N -BMDB62044 103.03951909 "Gamma Hydroxybutyric Acid" C4H7O3 SJZRECIVHVDYJC-UHFFFAOYSA-M -BMDB62045 182.999013721 Saccharin C7H5NO3S CVHZOJJKTDOEJC-UHFFFAOYSA-N -BMDB62046 270.255880332 "(S)-14-Methylhexadecanoic acid" C17H34O2 FXUKWLSZZHVEJD-UHFFFAOYSA-N -BMDB62047 256.240230268 "Isopalmitic acid" C16H32O2 ZONJATNKKGGVSU-UHFFFAOYSA-N -BMDB62048 228.20893014 "12-Methyltridecanoic acid" C14H28O2 YYVJAABUJYRQJO-UHFFFAOYSA-N -BMDB62049 198.161979948 "11-Dodecenoic acid" C12H22O2 GZZPOFFXKUVNSW-UHFFFAOYSA-N -BMDB62050 143.040484605 5-(2-Hydroxyethyl)-4-methylthiazole C6H9NOS BKAWJIRCKVUVED-UHFFFAOYSA-N -BMDB62051 107.073499293 Benzylamine C7H9N WGQKYBSKWIADBV-UHFFFAOYSA-N -BMDB62052 344.13186161 Lactitol C12H24O11 VQHSOMBJVWLPSR-UHFFFAOYSA-N -BMDB62053 193.025242271 Phosphocreatinine C4H8N3O4P HIPLEPXPNLWKCQ-UHFFFAOYSA-N -BMDB62054 342.116211546 beta-Lactose C12H22O11 GUBGYTABKSRVRQ-DCSYEGIMSA-N -BMDB62055 148.037173366 2-Hydroxyglutarate C5H8O5 HWXBTNAVRSUOJR-UHFFFAOYSA-N -BMDB62056 747.577805117 Phosphatidylethanolamine C41H82NO8P LVNGJLRDBYCPGB-KDXMTYKHSA-N -BMDB62057 162.052823422 1,2-diacylglycerol C6H10O5 OTBZCXAQBQMYNZ-LURJTMIESA-N -BMDB62058 242.224580204 "13-Methylmyristic acid" C15H30O2 ZOCYQVNGROEVLU-UHFFFAOYSA-N -BMDB62059 722.642440484 TG(14:0/14:0/14:0) C45H86O6 DUXYWXYOBMKGIN-UHFFFAOYSA-N -BMDB62060 778.70504074 TG(14:0/16:0/16:0) C49H94O6 JWVXCFSNEOMSHH-UHFFFAOYSA-N -BMDB62061 806.736340868 TG(14:0/16:0/18:0) C51H98O6 JTDPHURHZMZJHD-UHFFFAOYSA-N -BMDB62063 816.720690804 TG(14:0/16:0/18:2(9Z,12Z)) C52H96O6 SMQJAQBNDKFBQX-UCARQTEQSA-N -BMDB62064 802.70504074 TG(14:0/16:1(9Z)/18:1(9Z)) C51H94O6 QABWZGMVIDDGGI-WYERXJFXSA-N -BMDB62065 834.767640996 TG(14:0/18:0/18:0) C53H102O6 RDVFJKJMACSAJD-UHFFFAOYSA-N -BMDB62068 820.751990932 TG(15:0/16:0/18:0) C52H100O6 BABSZGMYWGFHOB-UHFFFAOYSA-N -BMDB62069 790.70504074 TG(16:0/15:0/16:1(9Z)) C50H94O6 PMHPAVPAGLAMOD-QOCHGBHMSA-N -BMDB62071 804.720690804 TG(16:0/14:1(9Z)/18:0) C51H96O6 FTSVKEQEERVOIA-SDXDJHTJSA-N -BMDB62075 862.798941124 TG(18:0/16:0/18:0) C55H106O6 ZGVGTPFSVCXVNJ-UHFFFAOYSA-N -BMDB62076 860.78329106 TG(18:0/16:0/18:1(9Z)) C55H104O6 WRXCJQWYSUUELD-RFBIWTDZSA-N -BMDB62077 282.255880335 "cis-13-Octadecenoic acid " C18H34O2 BDLLSHRIFPDGQB-UHFFFAOYSA-N -BMDB62079 858.767640996 TG(18:1(9Z)/16:0/18:1(9Z)) C55H102O6 PPTGNVIVNZLPPS-LBXGSASVSA-N -BMDB62083 268.240230268 "(Z)-9-Heptadecenoic acid" C17H32O2 QSBYPNXLFMSGKH-CMDGGOBGSA-N -BMDB62084 778.70504074 TG(14:0/14:0/18:0) C49H94O6 YQLXPOXDXQWEKE-UHFFFAOYSA-N -BMDB62085 806.736340868 TG(14:0/14:0/20:0) C51H98O6 ZARHKOGIOAZUIC-UHFFFAOYSA-N -BMDB62086 170.13067982 "3-Decenoic acid" C10H18O2 CPVUNKGURQKKKX-FPLPWBNLSA-N -BMDB62088 834.767640996 TG(14:0/16:0/20:0) C53H102O6 VGEMNMJCWPDGJU-UHFFFAOYSA-N -BMDB62089 242.224580206 "(+)-12-Methyltetradecanoic acid" C15H30O2 XKLJLHAPJBUBNL-UHFFFAOYSA-N -BMDB62090 568.506675286 1,2-Dipalmitoylglycerol C35H68O5 JEJLGIQLPYYGEE-UHFFFAOYSA-N -BMDB62091 214.193280077 "11-Methyldodecanoic acid" C13H26O2 SIOLDWZBFABPJU-UHFFFAOYSA-N -BMDB62092 270.255880335 "15-Methylhexadecanoic acid" C17H34O2 IIUXHTGBZYEGHI-UHFFFAOYSA-N -BMDB62093 151.063328537 "4-(Methylamino)benzoic acid" C8H9NO2 ZVIDMSBTYRSMAR-UHFFFAOYSA-N -BMDB62094 272.089602866 4-Hydroxyphenyl-beta-glucopyranoside C12H16O7 BJRNKVDFDLYUGJ-RMPHRYRLSA-N -BMDB62095 144.089877638 Adipamide C6H12N2O2 GVNWZKBFMFUVNX-UHFFFAOYSA-N -BMDB62096 342.116211546 beta-D-Fructofuranosyl-(2,1)-beta-D-Fructofuranose C12H22O11 WOHYVFWWTVNXTP-IYDDCBTQSA-N -BMDB62097 282.255880332 "cis-11-Octadecenoic acid" C18H34O2 UWHZIFQPPBDJPM-FPLPWBNLSA-N -BMDB62098 282.255880335 "cis-12-Octadecenoic acid" C18H34O2 OXEDXHIBHVMDST-SREVYHEPSA-N -BMDB62099 282.255880335 "cis-15-Octadecenoic acid" C18H34O2 KSIKGJKZYDOVFA-UHFFFAOYSA-N -BMDB62100 292.090665498 "Ethylenediaminetetraacetic acid" C10H16N2O8 KCXVZYZYPLLWCC-UHFFFAOYSA-N -BMDB62101 232.154334613 Isobutyrylcarnitine C11H22NO4 LRCNOZRCYBNMEP-SECBINFHSA-O -BMDB62102 194.07903818 "Methyl alpha-D-glucopyranoside" C7H14O6 HOVAGTYPODGVJG-ZFYZTMLRSA-N -BMDB62103 293.111066589 "N-acetyl-Muramic acid" C11H19NO8 MNLRQHMNZILYPY-MKFCKLDKSA-N -BMDB62104 342.116211528 Sophorose C12H22O11 HIWPGCMGAMJNRG-NCFXGAEVSA-N -BMDB62105 282.255880332 "trans-10 Octadecenoic acid" C18H34O2 QXJSBBXBKPUZAA-CMDGGOBGSA-N -BMDB62106 282.255880335 "trans-12-Octadecenoic acid" C18H34O2 OXEDXHIBHVMDST-VOTSOKGWSA-N -BMDB62107 282.255880332 "trans-13-Octadecenoic acid" C18H34O2 BDLLSHRIFPDGQB-AATRIKPKSA-N -BMDB62108 282.255880335 "trans-14-Octadecenoic acid" C18H34O2 JQBJOWDLTJOBRO-SNAWJCMRSA-N -BMDB62109 282.255880335 "trans-15-Octadecenoic acid" C18H34O2 KSIKGJKZYDOVFA-ONEGZZNKSA-N -BMDB62110 282.255880335 "trans-16-Octadecenoic acid" C18H34O2 DPUHOWDIWWPPIP-NSCUHMNNSA-N -BMDB62111 282.255880335 "trans-4-Octadecenoic acid" C18H34O2 OBNDIDKDLXSSCB-CCEZHUSRSA-N -BMDB62112 282.255880335 "trans-5-Octadecenoic acid" C18H34O2 AQWHMKSIVLSRNY-BUHFOSPRSA-N -BMDB62113 282.255880332 "trans-6-Octadecenoic acid" C18H34O2 CNVZJPUDSLNTQU-OUKQBFOZSA-N -BMDB62114 282.255880332 "trans-7-Octadecenoic acid" C18H34O2 RVUCYJXFCAVHNC-VAWYXSNFSA-N -BMDB62115 282.255880335 "trans-8-Octadecenoic acid" C18H34O2 WRIDQFICGBMAFQ-ZHACJKMWSA-N -BMDB62116 178.062994186 trans-Coniferylaldehyde C10H10O3 DKZBBWMURDFHNE-NSCUHMNNSA-N -BMDB62117 166.062994186 "Tropic acid" C9H10O3 JACRWUWPXAESPB-UHFFFAOYSA-N -BMDB62118 390.152597052 Loganin C17H26O10 AMBQHHVBBHTQBF-UOUCRYGSSA-N -BMDB62119 180.063388106 Talose C6H12O6 WQZGKKKJIJFFOK-WHZQZERISA-N -BMDB62120 1852.966985582 "Disialoganglioside Ib" C84H148N4O40 VPUOVUBYFYUBRY-INNWTUFDSA-N -BMDB62121 1545.87665445 "Monosialoganglioside GM1" C73H131N3O31 QPJBWNIQKHGLAU-BVLUPYCXSA-N -BMDB62122 1397.839481093 "Monosialoganglioside GM2" C68H123N3O26 USMMPBVNWHAJBE-YMEOXFOQSA-N -BMDB62123 1262.822708828 "Monosialoganglioside GM3" C65H118N2O21 PFJKOHUKELZMLE-VEUXDRLPSA-N -BMDB62124 582.485939845 TG(14:0/14:0/4:0) C35H66O6 CPUBTQNPGNMTLT-UHFFFAOYSA-N -BMDB62125 610.517239974 TG(14:0/14:0/6:0) C37H70O6 RLJXXZJSIPCFFV-UHFFFAOYSA-N -BMDB62126 610.517239974 TG(14:0/16:0/4:0) C37H70O6 SQKOCYHMNMIISZ-UHFFFAOYSA-N -BMDB62127 638.548540103 TG(14:0/16:0/6:0) C39H74O6 DWIUNYGOSZKHPJ-UHFFFAOYSA-N -BMDB62128 554.454639716 TG(16:0/10:0/4:0) C33H62O6 NMPTUNQSGSBSHZ-UHFFFAOYSA-N -BMDB62129 582.485939845 TG(16:0/10:0/6:0) C35H66O6 QKLBUEWDUVXZCS-UHFFFAOYSA-N -BMDB62130 582.485939845 TG(16:0/12:0/4:0) C35H66O6 DNRWLLOQTTWJKS-UHFFFAOYSA-N -BMDB62131 610.517239974 TG(16:0/12:0/6:0) C37H70O6 OGVRYRODVYXWHK-UHFFFAOYSA-N -BMDB62132 694.61114036 TG(16:0/14:0/10:0) C43H82O6 SMIGULGEODNQEX-UHFFFAOYSA-N -BMDB62133 750.673740612 TG(16:0/14:0/14:0) C47H90O6 AMXRERGJDVUTMF-UHFFFAOYSA-N -BMDB62134 610.517239974 TG(16:0/14:0/4:0) C37H70O6 ZRSCOWDQAGAMTK-UHFFFAOYSA-N -BMDB62135 638.548540103 TG(16:0/14:0/6:0) C39H74O6 CRYHRFJZXLSNCF-UHFFFAOYSA-N -BMDB62136 722.642440489 TG(16:0/16:0/10:0) C45H86O6 WBURFJXMBPWRIG-UHFFFAOYSA-N -BMDB62137 750.673740618 TG(16:0/16:0/12:0) C47H90O6 ZCHDZACIKMGEJU-UHFFFAOYSA-N -BMDB62138 778.70504074 TG(16:0/16:0/14:0) C49H94O6 JWVXCFSNEOMSHH-UHFFFAOYSA-N -BMDB62139 638.548540103 TG(16:0/16:0/4:0) C39H74O6 SPNPZKFZBBJGJK-UHFFFAOYSA-N -BMDB62140 666.579840232 TG(16:0/16:0/6:0) C41H78O6 SAYUNMDZOOEJHF-UHFFFAOYSA-N -BMDB62141 694.61114036 TG(16:0/16:0/8:0) C43H82O6 RFWJYKONNDGWCW-UHFFFAOYSA-N -BMDB62142 666.579840232 TG(16:0/18:0/4:0) C41H78O6 QDICJGWYEVKHJA-UHFFFAOYSA-N -BMDB62143 638.548540103 TG(18:0/14:0/4:0) C39H74O6 GNPZHHYWFFYGOF-UHFFFAOYSA-N -BMDB62144 666.579840232 TG(18:0/14:0/6:0) C41H78O6 BYIJSVHOFIDXCL-UHFFFAOYSA-N -BMDB62145 666.579840232 TG(18:0/16:0/4:0) C41H78O6 MSBNBDZZIPTJCP-UHFFFAOYSA-N -BMDB62146 694.61114036 TG(18:0/16:0/6:0) C43H82O6 NJJSVYBVDBGZKT-UHFFFAOYSA-N -BMDB62147 214.193280077 "(+)-10-Methyldodecanoic acid" C13H26O2 YETWOCQNUTWSQA-UHFFFAOYSA-N -BMDB62148 280.24023027 "trans-11,cis-15-Octadecadienoic acid" C18H32O2 HHELYEVVXBEXIZ-ODYTWBPASA-N -BMDB62149 280.24023027 "12E, 14E-Octadecadienoic acid" C18H32O2 NLGIQISOWDWGRJ-YTXTXJHMSA-N -BMDB62150 280.24023027 "11E, 13E-Octadecadienoic acid" C18H32O2 JGFMXQLVWUGIPI-BSWSSELBSA-N -BMDB62151 280.24023027 "10E, 12E-Octadecadienoic acid" C18H32O2 GKJZMAHZJGSBKD-BLHCBFLLSA-N -BMDB62152 280.24023027 "8E, 10E-Octadecadienoic acid" C18H32O2 QJKCKUNKNNYJNS-BNFZFUHLSA-N -BMDB62153 280.24023027 "7E, 9E-Octadecadienoic acid" C18H32O2 HACBQSMIIGXKGA-HULFFUFUSA-N -BMDB62154 526.423339588 TG(6:0/8:0/14:0) C31H58O6 HMYXRAROFDYZSY-UHFFFAOYSA-N -BMDB62155 526.423339588 TG(4:0/8:0/16:0) C31H58O6 DQSUYNONXLJKFQ-UHFFFAOYSA-N -BMDB62156 526.423339588 TG(4:0/10:0/14:0) C31H58O6 CZNCEKYZOLXFEW-UHFFFAOYSA-N -BMDB62157 554.454639716 TG(6:0/10:0/14:0) C33H62O6 CTUNPMWDIDEHLG-UHFFFAOYSA-N -BMDB62158 554.454639716 TG(4:0/10:0/16:0) C33H62O6 NMPTUNQSGSBSHZ-UHFFFAOYSA-N -BMDB62159 554.454639716 TG(4:0/12:0/14:0) C33H62O6 SPIIOGCAPPVNDU-UHFFFAOYSA-N -BMDB62160 582.485939845 TG(10:0/16:0/6:0) C35H66O6 CBCAPZYHHAJWQD-UHFFFAOYSA-N -BMDB62161 582.485939845 TG(6:0/12:0/14:0) C35H66O6 XTWZFTFRQTXTLI-UHFFFAOYSA-N -BMDB62162 582.485939845 TG(4:0/12:0/16:0) C35H66O6 DNRWLLOQTTWJKS-UHFFFAOYSA-N -BMDB62163 582.485939845 TG(4:0/14:0/14:0) C35H66O6 CPUBTQNPGNMTLT-UHFFFAOYSA-N -BMDB62164 596.50158991 TG(4:0/14:0/15:0) C36H68O6 JMGKZUFRLWPSBP-UHFFFAOYSA-N -BMDB62165 610.517239974 TG(6:0/12:0/16:0) C37H70O6 OGVRYRODVYXWHK-UHFFFAOYSA-N -BMDB62166 610.517239974 TG(6:0/14:0/14:0) C37H70O6 RLJXXZJSIPCFFV-UHFFFAOYSA-N -BMDB62167 610.517239974 TG(8:0/12:0/14:0) C37H70O6 RJHHICMBDSUIHF-UHFFFAOYSA-N -BMDB62168 610.517239974 TG(4:0/14:0/16:0) C37H70O6 ZRSCOWDQAGAMTK-UHFFFAOYSA-N -BMDB62169 624.532890038 TG(4:0/15:0/16:0) C38H72O6 PCDSPVRPORJHDW-UHFFFAOYSA-N -BMDB62170 638.548540103 TG(6:0/14:0/16:0) C39H74O6 CRYHRFJZXLSNCF-UHFFFAOYSA-N -BMDB62171 638.548540103 TG(4:0/14:0/18:0) C39H74O6 GNPZHHYWFFYGOF-UHFFFAOYSA-N -BMDB62172 638.548540103 TG(4:0/17:0/15:0) C39H74O6 CYIZPZFVFXXNAW-UHFFFAOYSA-N -BMDB62173 638.548540103 TG(4:0/16:0/16:0) C39H74O6 SPNPZKFZBBJGJK-UHFFFAOYSA-N -BMDB62174 652.564190167 TG(4:0/15:0/18:0) C40H76O6 SORNCPQAUOVNGB-UHFFFAOYSA-N -BMDB62175 652.564190167 TG(4:0/16:0/17:0) C40H76O6 VJWVCPAYJXNGCJ-UHFFFAOYSA-N -BMDB62176 666.579840232 TG(6:0/16:0/16:0) C41H78O6 SAYUNMDZOOEJHF-UHFFFAOYSA-N -BMDB62177 666.579840232 TG(8:0/14:0/16:0) C41H78O6 LONDUFXOLIQUKZ-UHFFFAOYSA-N -BMDB62178 666.579840232 TG(10:0/14:0/14:0) C41H78O6 OECYYRPLQTZAGN-UHFFFAOYSA-N -BMDB62179 666.579840232 TG(12:0/12:0/14:0) C41H78O6 SMUUMIRCIBXLGI-LHEWISCISA-N -BMDB62180 666.579840232 TG(4:0/16:0/18:0) C41H78O6 MSBNBDZZIPTJCP-UHFFFAOYSA-N -BMDB62181 694.61114036 TG(6:0/16:0/18:0) C43H82O6 NJJSVYBVDBGZKT-UHFFFAOYSA-N -BMDB62182 694.61114036 TG(8:0/16:0/16:0) C43H82O6 RFWJYKONNDGWCW-UHFFFAOYSA-N -BMDB62183 694.61114036 TG(10:0/16:0/14:0) C43H82O6 ZBYLOVWUEAWMBM-UHFFFAOYSA-N -BMDB62184 694.61114036 TG(12:0/14:0/14:0) C43H82O6 UGBCBXMLXHJYBS-FAIXQHPJSA-N -BMDB62185 694.61114036 TG(4:0/18:0/18:0) C43H82O6 XFFRLQGZYVVLQI-UHFFFAOYSA-N -BMDB62186 722.642440489 TG(6:0/16:0/20:0) C45H86O6 DFKKDPLHBBTFFO-UHFFFAOYSA-N -BMDB62187 722.642440489 TG(6:0/18:0/18:0) C45H86O6 WZPUIXJVKWWFBH-UHFFFAOYSA-N -BMDB62188 722.642440489 TG(8:0/16:0/18:0) C45H86O6 SXRIIQRGPQMOSV-UHFFFAOYSA-N -BMDB62189 722.642440489 TG(10:0/16:0/16:0) C45H86O6 WBURFJXMBPWRIG-UHFFFAOYSA-N -BMDB62190 722.642440489 TG(12:0/14:0/16:0) C45H86O6 PGZSAELMQZLYOA-WBCKFURZSA-N -BMDB62191 778.705040747 TG(12:0/14:0/20:0) C49H94O6 FNKDFKYDCKFOPA-UHFFFAOYSA-N -BMDB62192 778.705040747 TG(12:0/16:0/18:0) C49H94O6 HBNALZRPCNRSPZ-YACUFSJGSA-N -BMDB62193 820.75199094 TG(14:0/17:0/18:0) C52H100O6 DIMXBKATFQGNNF-UHFFFAOYSA-N -BMDB62194 192.02700261 "Glucaric acid-1,4-lactone" C6H8O7 XECPAIJNBXCOBO-MMPJQOAZSA-N -BMDB62195 194.07903818 "Methyl beta-D-glucopyranoside" C7H14O6 HOVAGTYPODGVJG-VOQCIKJUSA-N -BMDB62196 224.141244504 "Methyl jasmonate" C13H20O3 GEWDNTWNSAZUDX-XXJOZFEBSA-N -BMDB62197 213.100107973 "N-(2-Oxohexanoyl)homoserine lactone" C10H15NO4 HXDSMMVKIYAMIA-ZETCQYMHSA-N -BMDB62204 336.057837322 "Thiamine hydrochloride" C12H18Cl2N4OS DPJRMOMPQZCRJU-UHFFFAOYSA-M -BMDB62205 310.287180464 "Gadoleic acid" C20H38O2 LQJBNNIYVWPHFW-QXMHVHEDSA-N -BMDB62210 94.041864814 Phenol C6H6O ISWSIDIOOBJBQZ-UHFFFAOYSA-N -BMDB62211 168.042258738 "Vanillic acid" C8H8O4 WKOLLVMJNQIZCI-UHFFFAOYSA-N -BMDB62212 138.031694053 "Salicylic acid" C7H6O3 YGSDEFSMJLZEOE-UHFFFAOYSA-N -BMDB62213 135.035399227 Methylcysteine C4H9NO2S IDIDJDIHTAOVLG-VKHMYHEASA-N -BMDB62214 136.0524295 "2-Methylbenzoic acid" C8H8O2 ZWLPBLYKEWSWPD-UHFFFAOYSA-N -BMDB62215 120.042258744 Erythrose C4H8O4 FMAORJIQYMIRHF-HERZVMAMSA-N -BMDB62216 229.088497429 Ergothioneine C9H15N3O2S SSISHJJTAXXQAX-ZETCQYMHSA-N -BMDB62217 244.08479226 Indolylacryloylglycine C13H12N2O3 DUIFVCFSAWHIOD-AATRIKPKSA-N -BMDB62218 187.120843415 N-Heptanoylglycine C9H17NO3 RNFCYFVPNIXAHP-UHFFFAOYSA-N -BMDB62219 230.212004145 Capryloylcholine C13H28NO2 AKYPZHWYYXDGEW-UHFFFAOYSA-N -BMDB62221 204.074621504 "Alanyl-Aspartic acid" C7H12N2O5 XAEWTDMGFGHWFK-UHFFFAOYSA-N -BMDB62222 226.106590334 Alanyl-Histidine C9H14N4O3 XZWXFWBHYRFLEF-UHFFFAOYSA-N -BMDB62223 186.100442324 Alanyl-Proline C8H14N2O3 WPWUFUBLGADILS-UHFFFAOYSA-N -BMDB62224 252.11100701 Alanyl-Tyrosine C12H16N2O4 ALZVPLKYDKJKQU-UHFFFAOYSA-N -BMDB62225 277.120860189 Arginyl-Cysteine C9H19N5O3S OSASDIVHOSJVII-UHFFFAOYSA-N -BMDB62226 263.093976737 Asparaginyl-Methionine C9H17N3O4S IQTUDDBANZYMAR-UHFFFAOYSA-N -BMDB62227 289.138618743 Aspartyl-Arginine C10H19N5O5 PSZNHSNIGMJYOZ-UHFFFAOYSA-N -BMDB62228 232.105921632 Aspartyl-Valine C9H16N2O5 CPMKYMGGYUFOHS-UHFFFAOYSA-N -BMDB62229 235.062676609 Cysteinyl-Asparagine C7H13N3O4S AYKQJQVWUYEZNU-UHFFFAOYSA-N -BMDB62230 208.051777572 Cysteinyl-Serine C6H12N2O4S YXQDRIRSAHTJKM-UHFFFAOYSA-N -BMDB62231 283.128054047 Glutaminylhistidine C11H17N5O4 JZOYFBPIEHCDFV-YUMQZZPRSA-N -BMDB62232 274.164105204 Glutaminyllysine C11H22N4O4 CLSDNFWKGFJIBZ-YUMQZZPRSA-N -BMDB62233 293.137556104 Glutaminylphenylalanine C14H19N3O4 VHLZDSUANXBJHW-QWRGUYRKSA-N -BMDB62234 231.133139435 Glycyl-Arginine C8H17N5O3 JLXVRFDTDUGQEE-UHFFFAOYSA-N -BMDB62235 222.100442324 Glycyl-Phenylalanine C11H14N2O3 JBCLFWXMTIKCCB-UHFFFAOYSA-N -BMDB62236 162.064056818 Glycyl-Serine C5H10N2O4 BCCRXDTUTZHDEU-UHFFFAOYSA-N -BMDB62237 238.095356946 Glycyl-Tyrosine C11H14N2O4 XBGGUPMXALFZOT-UHFFFAOYSA-N -BMDB62238 269.112403993 Histidinyl-Asparagine C10H15N5O4 WSDOHRLQDGAOGU-UHFFFAOYSA-N -BMDB62239 258.078661024 Histidinyl-Cysteine C9H14N4O3S MAJYPBAJPNUFPV-UHFFFAOYSA-N -BMDB62240 252.122240398 Histidinyl-Proline C11H16N4O3 LNCFUHAPNTYMJB-UHFFFAOYSA-N -BMDB62241 341.148789499 Histidinyl-Tryptophan C17H19N5O3 FBTYOQIYBULKEH-UHFFFAOYSA-N -BMDB62242 254.137890462 Histidinyl-Valine C11H18N4O3 VLDVBZICYBVQHB-UHFFFAOYSA-N -BMDB62243 202.131742452 Leucyl-Alanine C9H18N2O3 HSQGMTRYSIHDAC-UHFFFAOYSA-N -BMDB62244 246.121571696 Leucyl-Aspartate C10H18N2O5 DVCSNHXRZUVYAM-UHFFFAOYSA-N -BMDB62245 244.178692644 Leucyl-Leucine C12H24N2O3 LCPYQJIKPJDLLB-UHFFFAOYSA-N -BMDB62246 218.126657074 Leucyl-Serine C9H18N2O4 XGDCYUQSFDQISZ-UHFFFAOYSA-N -BMDB62247 317.173941617 Leucyl-Tryptophan C17H23N3O3 BQVUABVGYYSDCJ-UHFFFAOYSA-N -BMDB62248 203.126991425 Lysyl-Glycine C8H17N3O3 HGNRJCINZYHNOU-UHFFFAOYSA-N -BMDB62249 274.200490718 Lysyl-Lysine C12H26N4O3 NVGBPTNZLWRQSY-UHFFFAOYSA-N -BMDB62250 293.173941617 Lysyl-Phenylalanine C15H23N3O3 QCZYYEFXOBKCNQ-UHFFFAOYSA-N -BMDB62251 220.088163078 Methionyl-Alanine C8H16N2O3S JHKXZYLNVJRAAJ-UHFFFAOYSA-N -BMDB62252 263.093976737 Methionyl-Asparagine C9H17N3O4S JMEWFDUAFKVAAT-UHFFFAOYSA-N -BMDB62253 246.103813142 Methionyl-Proline C10H18N2O3S DZMGFGQBRYWJOR-UHFFFAOYSA-N -BMDB62254 236.116092388 Phenylalanyl-Alanine C12H16N2O3 MIDZLCFIAINOQN-UHFFFAOYSA-N -BMDB62255 222.100442324 Phenylalanyl-Glycine C11H14N2O3 GLUBLISJVJFHQS-UHFFFAOYSA-N -BMDB62256 229.106255983 Prolyl-Asparagine C9H15N3O4 JQOHKCDMINQZRV-UHFFFAOYSA-N -BMDB62257 252.122240398 Prolyl-Histidine C11H16N4O3 BEPSGCXDIVACBU-UHFFFAOYSA-N -BMDB62258 236.0830777 Serylmethionine C8H16N2O4S PBUXMVYWOSKHMF-UHFFFAOYSA-N -BMDB62259 291.121906047 Seryltryptophan C14H17N3O4 LZLREEUGSYITMX-UHFFFAOYSA-N -BMDB62260 234.08518619 Threoninyl-Aspartate C8H14N2O6 IOWJRKAVLALBQB-UHFFFAOYSA-N -BMDB62261 305.137556111 Threoninyl-Tryptophan C15H19N3O4 KAFKKRJQHOECGW-UHFFFAOYSA-N -BMDB62262 218.126657074 Threoninyl-Valine C9H18N2O4 CKHWEVXPLJBEOZ-UHFFFAOYSA-N -BMDB62263 360.190988664 Tryptophyl-Arginine C17H24N6O3 LCPVBXOHXMBLFW-UHFFFAOYSA-N -BMDB62264 317.173941617 Tryptophyl-Leucine C17H23N3O3 LYMVXFSTACVOLP-UHFFFAOYSA-N -BMDB62265 294.157957202 Tyrosyl-Leucine C15H22N2O4 AUEJLPRZGVVDNU-UHFFFAOYSA-N -BMDB62266 280.142307138 Tyrosyl-Valine C14H20N2O4 OYOQKMOWUDVWCR-UHFFFAOYSA-N -BMDB62267 273.180089627 Valyl-Arginine C11H23N5O3 IBIDRSSEHFLGSD-UHFFFAOYSA-N -BMDB62268 230.16304258 Valyl-Leucine C11H22N2O3 XCTHZFGSVQBHBW-UHFFFAOYSA-N -BMDB62269 214.131742452 Valyl-Proline C10H18N2O3 GIAZPLMMQOERPN-UHFFFAOYSA-N -BMDB62270 122.073164942 4-Ethylphenol C8H10O HXDOZKJGKXYMEW-UHFFFAOYSA-N -BMDB62271 161.068807845 Acetylhomoserine C6H11NO4 FCXZBWSIAGGPCB-UHFFFAOYSA-N -BMDB62272 162.064056818 L-4-Hydroxyglutamine C5H10N2O4 VTJRNXQBJNWLRA-UHFFFAOYSA-N -BMDB62273 84.093900384 Cyclohexane C6H12 XDTMQSROBMDMFD-UHFFFAOYSA-N -BMDB62274 104.047344122 "Ethoxyacetic acid" C4H8O3 YZGQDNOIGFBYKF-UHFFFAOYSA-N -BMDB62275 142.135765198 3-Nonanone C9H18O IYTXKIXETAELAV-UHFFFAOYSA-N -BMDB62276 138.05032101 "Benzyl methyl sulfide" C8H10S OFQPKKGMNWASPN-UHFFFAOYSA-N -BMDB62277 99.104799421 Cyclohexylamine C6H13N PAFZNILMFXTMIY-UHFFFAOYSA-N -BMDB62278 116.120115134 1-Heptanol C7H16O BBMCTIGTTCKYKF-UHFFFAOYSA-N -BMDB62279 103.063328537 "3-Aminobutanoic acid" C4H9NO2 OQEBBZSWEGYTPG-UHFFFAOYSA-N -BMDB62280 197.080041233 N-Acetylhistidine C8H11N3O3 KBOJOGQFRVVWBH-UHFFFAOYSA-N -BMDB62281 222.110338308 "Isopropyl beta-D-glucoside" C9H18O6 UOEFDXYUEPHESS-UHFFFAOYSA-N -BMDB62282 158.13067982 "Pentyl butanoate" C9H18O2 CFNJLPHOBMVMNS-UHFFFAOYSA-N -BMDB62283 129.057849229 Isoquinoline C9H7N AWJUIBRHMBBTKR-UHFFFAOYSA-N -BMDB62284 85.089149357 Piperidine C5H11N NQRYJNQNLNOLGT-UHFFFAOYSA-N -BMDB62285 197.068807845 N-Hydroxy-l-tyrosine C9H11NO4 CNIUEVQJABPUIJ-UHFFFAOYSA-N -BMDB62287 750.673740618 TG(14:0/14:0/16:0) C47H90O6 AMXRERGJDVUTMF-SJARJILFSA-N -BMDB62288 748.658090554 TG(14:0/14:0/16:1(9Z)) C47H88O6 UZLGGKDLJGDGEY-ZJNAVBKXSA-N -BMDB62289 798.673740618 TG(14:0/14:0/20:4(5Z,8Z,11Z,14Z)) C51H90O6 KIZWKFNHVBOAMA-QXVCXXNRSA-N -BMDB62290 770.642440489 TG(14:0/14:0/18:4(6Z,9Z,12Z,15Z)) C49H86O6 NGZSPVCWAUNMGC-YZZQZZOJSA-N -BMDB62292 750.673740618 TG(14:0/15:0/15:0) C47H90O6 ROBJWPSKKQDYDD-SJARJILFSA-N -BMDB62293 734.642440489 TG(14:0/15:0/14:1(9Z)) C46H86O6 PYWBOTIEOHDIPF-FKFLSBRZSA-N -BMDB62294 790.705040747 TG(14:0/15:0/18:1(9Z)) C50H94O6 LPFCBOFEKLNOFO-BQDYWPKPSA-N -BMDB62295 846.767641004 TG(14:0/15:0/22:1(13Z)) C54H102O6 AHYXNVIQMVRTEC-SQWFITPDSA-N -BMDB62296 750.673740612 TG(14:0/16:0/14:0) C47H90O6 UXWDTZNNQVHGSG-UHFFFAOYSA-N -BMDB62297 748.658090554 TG(14:0/16:0/14:1(9Z)) C47H88O6 LKQZQPJLOPLSMV-HZMXKNRLSA-N -BMDB62298 798.673740618 TG(14:0/16:0/18:4(6Z,9Z,12Z,15Z)) C51H90O6 OERBUNDZQSEJCT-ZQWASXBHSA-N -BMDB62299 734.642440489 TG(14:0/14:1(9Z)/15:0) C46H86O6 KHAUMDGBIRUXME-LNSHZACTSA-N -BMDB62300 748.658090554 TG(14:0/14:1(9Z)/16:0) C47H88O6 JRZPEKVQFIJQHH-CTJRCAHCSA-N -BMDB62302 770.642440489 TG(14:0/14:1(9Z)/18:3(6Z,9Z,12Z)) C49H86O6 QCZQFGBWINSNLX-HXZWHNRWSA-N -BMDB62304 770.642440489 TG(14:0/14:1(9Z)/18:3(9Z,12Z,15Z)) C49H86O6 CIZXNEUTBLZDKD-OZYUBDJZSA-N -BMDB62305 748.658090548 TG(14:0/16:1(9Z)/14:0) C47H88O6 JJUUQTPTIFXQFZ-QOCHGBHMSA-N -BMDB62306 798.673740618 TG(14:0/16:1(9Z)/18:3(6Z,9Z,12Z)) C51H90O6 MBKZQWBNVBZDCB-ISUKPBISSA-N -BMDB62307 798.673740618 TG(14:0/16:1(9Z)/18:3(9Z,12Z,15Z)) C51H90O6 YADAGWFRJZDFQR-NGYNEUHUSA-N -BMDB62309 790.705040747 TG(14:0/18:1(9Z)/15:0) C50H94O6 QWQOHDRXOBOYKI-BQDYWPKPSA-N -BMDB62311 846.767641004 TG(14:0/22:1(13Z)/15:0) C54H102O6 LHQXGAXTQZVWAA-SQWFITPDSA-N -BMDB62312 770.642440489 TG(14:0/18:3(6Z,9Z,12Z)/14:1(9Z)) C49H86O6 ZXIYVSKARHZKFI-JMXIBXGVSA-N -BMDB62313 798.673740618 TG(14:0/18:3(6Z,9Z,12Z)/16:1(9Z)) C51H90O6 XAVJKUHRLWVFLG-ZPDOMMFMSA-N -BMDB62315 798.673740612 TG(14:0/20:4(5Z,8Z,11Z,14Z)/14:0) C51H90O6 WDRRUHMNCUBQST-VUAUWLMFSA-N -BMDB62316 770.642440489 TG(14:0/18:3(9Z,12Z,15Z)/14:1(9Z)) C49H86O6 NWBHQWSBDNIZGS-PJWQHDJPSA-N -BMDB62317 798.673740618 TG(14:0/18:3(9Z,12Z,15Z)/16:1(9Z)) C51H90O6 FAOJWEAKPNBWHR-NGYNEUHUSA-N -BMDB62318 770.642440484 TG(14:0/18:4(6Z,9Z,12Z,15Z)/14:0) C49H86O6 WMFKLVFQRXZMAB-PFBCYAMXSA-N -BMDB62319 798.673740618 TG(14:0/18:4(6Z,9Z,12Z,15Z)/16:0) C51H90O6 OATMICFDINFCGJ-VTBOKXQCSA-N -BMDB62321 750.673740612 TG(15:0/14:0/15:0) C47H90O6 MLEFRDDBNGCWLN-UHFFFAOYSA-N -BMDB62322 734.642440489 TG(15:0/14:0/14:1(9Z)) C46H86O6 ICZGKLJORYWADN-FKFLSBRZSA-N -BMDB62324 790.705040747 TG(15:0/14:0/18:1(9Z)) C50H94O6 QJSQJKZBMJFBNS-BQDYWPKPSA-N -BMDB62325 846.767641004 TG(15:0/14:0/22:1(13Z)) C54H102O6 HWVIZZONLQJAIA-SQWFITPDSA-N -BMDB62326 748.658090554 TG(15:0/15:0/14:1(9Z)) C47H88O6 JLZYFORTRUGDQW-YVCFFHMXSA-N -BMDB62327 798.673740618 TG(15:0/15:0/18:4(6Z,9Z,12Z,15Z)) C51H90O6 QSFMAXBBEXQJKS-QPNZBUHMSA-N -BMDB62328 790.705040747 TG(15:0/16:0/16:1(9Z)) C50H94O6 RCYIETYFTUBXFK-KWLHUJJFSA-N -BMDB62329 846.767641004 TG(15:0/16:0/20:1(11Z)) C54H102O6 SUYGGHGLHBZSPT-HGUUATKKSA-N -BMDB62330 790.705040747 TG(15:0/18:0/14:1(9Z)) C50H94O6 CFCHREDNKRFVCW-PDJUYAFRSA-N -BMDB62332 846.767641004 TG(15:0/18:0/18:1(9Z)) C54H102O6 NTCKBJDZYIUTCZ-CBOCDEIPSA-N -BMDB62334 846.767641004 TG(15:0/20:0/16:1(9Z)) C54H102O6 NCSPONLYMUMKKP-KMIVGPLPSA-N -BMDB62339 924.814591198 TG(15:0/20:0/22:4(7Z,10Z,13Z,16Z)) C60H108O6 HDDXOXZZGUTMGH-KUINUKFBSA-N -BMDB62340 846.767641004 TG(15:0/22:0/14:1(9Z)) C54H102O6 ZZCNJAJGZOISDU-WAEMFQRBSA-N -BMDB62342 900.814591198 TG(15:0/22:0/18:2(9Z,12Z)) C58H108O6 SNCWETBQRMVHOV-KYEYXGJPSA-N -BMDB62343 898.798941133 TG(15:0/22:0/18:3(6Z,9Z,12Z)) C58H106O6 IDANUBRXZAZNTQ-UNDCHBHASA-N -BMDB62346 924.814591198 TG(15:0/22:0/20:4(5Z,8Z,11Z,14Z)) C60H108O6 DXYNFUILRMSQEB-OUDMIXJTSA-N -BMDB62347 952.845891326 TG(15:0/22:0/22:4(7Z,10Z,13Z,16Z)) C62H112O6 NREQOBXZRZZFOK-ZZJCQLRLSA-N -BMDB62348 898.798941133 TG(15:0/22:0/18:3(9Z,12Z,15Z)) C58H106O6 GNXLOCJIEADZDN-UJKDMMPKSA-N -BMDB62351 928.845891326 TG(15:0/24:0/18:2(9Z,12Z)) C60H112O6 JFSKVJNMFDFHMR-PPLQAQDSSA-N -BMDB62352 926.830241262 TG(15:0/24:0/18:3(6Z,9Z,12Z)) C60H110O6 FOPOUQXJSFCKNT-FEFACAKXSA-N -BMDB62354 952.845891326 TG(15:0/24:0/20:4(5Z,8Z,11Z,14Z)) C62H112O6 ZXJDZGDJRTWYTF-JOUCEHFPSA-N -BMDB62356 926.830241262 TG(15:0/24:0/18:3(9Z,12Z,15Z)) C60H110O6 QHZQZFODHJGTEQ-YKMHXOHJSA-N -BMDB62357 924.814591198 TG(15:0/24:0/18:4(6Z,9Z,12Z,15Z)) C60H108O6 IRHTVXNQOMZIJV-UAQSPOJJSA-N -BMDB62359 748.658090548 TG(15:0/14:1(9Z)/15:0) C47H88O6 GSUGYNLLHVBBBD-SDXDJHTJSA-N -BMDB62360 790.705040747 TG(15:0/14:1(9Z)/18:0) C50H94O6 LFJDGJMMGMSVRP-GLKDPILHSA-N -BMDB62361 846.767641004 TG(15:0/14:1(9Z)/22:0) C54H102O6 RULYVNHKSZOHLQ-IALZTZDJSA-N -BMDB62362 776.725776191 TG(15:0/14:1(9Z)/o-18:0) C50H96O5 JRNGCNUTRCCORS-WGIOATGOSA-N -BMDB62363 790.705040747 TG(15:0/16:1(9Z)/16:0) C50H94O6 IFKIXRIDBLJVHR-ILNKAXEKSA-N -BMDB62364 846.767641004 TG(15:0/16:1(9Z)/20:0) C54H102O6 VCVDKBBECJTNHK-KMIVGPLPSA-N -BMDB62365 900.814591198 TG(15:0/16:1(9Z)/24:1(15Z)) C58H108O6 KZBGDZPDUHOLLM-BYOZWASUSA-N -BMDB62371 846.767641004 TG(15:0/18:1(9Z)/18:0) C54H102O6 XZOUIUJOUOGCSM-OLSVMMKASA-N -BMDB62372 900.814591198 TG(15:0/18:1(9Z)/22:1(13Z)) C58H108O6 OIKZZWRYPFNHCD-JPVYIBRBSA-N -BMDB62373 928.845891326 TG(15:0/18:1(9Z)/24:1(15Z)) C60H112O6 ITAYORXBJXQRPB-BVWQVLTHSA-N -BMDB62375 832.788376449 TG(15:0/18:1(9Z)/o-18:0) C54H104O5 TZCQBTHNJDZQCH-FEKLXSIDSA-N -BMDB62376 846.767641004 TG(15:0/20:1(11Z)/16:0) C54H102O6 SWXNEJDKPPZNDD-HGUUATKKSA-N -BMDB62377 900.814591198 TG(15:0/20:1(11Z)/20:1(11Z)) C58H108O6 WGECLQCBWONQQW-IMDNHMHNSA-N -BMDB62378 928.845891326 TG(15:0/20:1(11Z)/22:1(13Z)) C60H112O6 SQMJIJZRDJBURR-RQOLIHFSSA-N -BMDB62387 900.814591198 TG(15:0/22:1(13Z)/18:1(9Z)) C58H108O6 AZDRPNZSLUOCOF-JPVYIBRBSA-N -BMDB62388 928.845891326 TG(15:0/22:1(13Z)/20:1(11Z)) C60H112O6 JRDJTRWIPLQBPW-RQOLIHFSSA-N -BMDB62390 984.908491584 TG(15:0/22:1(13Z)/24:1(15Z)) C64H120O6 KCEKYYMOTIUAOR-IRVPXVQWSA-N -BMDB62391 898.798941133 TG(15:0/22:1(13Z)/18:2(9Z,12Z)) C58H106O6 BVUKOOZQIGAWRK-HRIHOIJHSA-N -BMDB62395 900.814591198 TG(15:0/24:1(15Z)/16:1(9Z)) C58H108O6 VECBQPDNQCMGKZ-BYOZWASUSA-N -BMDB62397 928.845891326 TG(15:0/24:1(15Z)/18:1(9Z)) C60H112O6 HUPZHZLPCVHVKU-BVWQVLTHSA-N -BMDB62399 984.908491584 TG(15:0/24:1(15Z)/22:1(13Z)) C64H120O6 XEMYZECDKVPSLH-IRVPXVQWSA-N -BMDB62400 926.830241262 TG(15:0/24:1(15Z)/18:2(9Z,12Z)) C60H110O6 AFBPXDLUPKBQFZ-IBUFINAASA-N -BMDB62401 924.814591198 TG(15:0/24:1(15Z)/18:3(6Z,9Z,12Z)) C60H108O6 UCHBEMFCQZHFSL-XKROISJUSA-N -BMDB62405 924.814591198 TG(15:0/24:1(15Z)/18:3(9Z,12Z,15Z)) C60H108O6 FMVSECQYWDCHHF-JGDRQJGZSA-N -BMDB62406 900.814591198 TG(15:0/18:2(9Z,12Z)/22:0) C58H108O6 AMDVCDGQSHKXKJ-KYEYXGJPSA-N -BMDB62407 928.845891326 TG(15:0/18:2(9Z,12Z)/24:0) C60H112O6 ZEBWOWFWNJDSCC-PPLQAQDSSA-N -BMDB62408 898.798941133 TG(15:0/18:2(9Z,12Z)/22:1(13Z)) C58H106O6 WUDWGAJJZFZCER-HRIHOIJHSA-N -BMDB62409 926.830241262 TG(15:0/18:2(9Z,12Z)/24:1(15Z)) C60H110O6 NVFWCMLYJFBSCK-IBUFINAASA-N -BMDB62410 898.798941133 TG(15:0/18:3(6Z,9Z,12Z)/22:0) C58H106O6 UYEQRCSOCOOKBP-SNGDCZRFSA-N -BMDB62411 926.830241262 TG(15:0/18:3(6Z,9Z,12Z)/24:0) C60H110O6 JAVPHHAAEYIKMM-KNGAKILKSA-N -BMDB62412 924.814591198 TG(15:0/18:3(6Z,9Z,12Z)/24:1(15Z)) C60H108O6 GKMORUSRTMSQMC-GUYHVJHPSA-N -BMDB62424 924.814591198 TG(15:0/20:4(5Z,8Z,11Z,14Z)/22:0) C60H108O6 JUGMYMSENHZDFP-XHFKUHIXSA-N -BMDB62425 952.845891326 TG(15:0/20:4(5Z,8Z,11Z,14Z)/24:0) C62H112O6 SXYVNHYLNOIFCY-OZPQAXABSA-N -BMDB62437 924.814591198 TG(15:0/22:4(7Z,10Z,13Z,16Z)/20:0) C60H108O6 PVAYKYVAJQFPGE-KDUWMNDDSA-N -BMDB62438 952.845891326 TG(15:0/22:4(7Z,10Z,13Z,16Z)/22:0) C62H112O6 SEPVTUBBDRBGTC-SJLNYWKTSA-N -BMDB62439 898.798941133 TG(15:0/18:3(9Z,12Z,15Z)/22:0) C58H106O6 RFTLYHXOQWFSCO-UJKDMMPKSA-N -BMDB62440 926.830241262 TG(15:0/18:3(9Z,12Z,15Z)/24:0) C60H110O6 GGDXZWHTUURKMJ-YKMHXOHJSA-N -BMDB62441 924.814591198 TG(15:0/18:3(9Z,12Z,15Z)/24:1(15Z)) C60H108O6 UJJXVIKWENGMNU-JGDRQJGZSA-N -BMDB62442 798.673740612 TG(15:0/18:4(6Z,9Z,12Z,15Z)/15:0) C51H90O6 DLCDFMLHLIWWGK-VNIKSONVSA-N -BMDB62443 924.814591198 TG(15:0/18:4(6Z,9Z,12Z,15Z)/24:0) C60H108O6 GPQRMWGHHPNZPB-RSWNSSALSA-N -BMDB62446 776.725776191 TG(15:0/o-18:0/14:1(9Z)) C50H96O5 OLSSXNRRHDUTHQ-WGIOATGOSA-N -BMDB62448 832.788376449 TG(15:0/o-18:0/18:1(9Z)) C54H104O5 REVTZIGEZSBYTI-INSBXERHSA-N -BMDB62450 748.658090554 TG(16:0/14:0/14:1(9Z)) C47H88O6 ZLMFSPKUPXCIHA-HZMXKNRLSA-N -BMDB62451 798.673740618 TG(16:0/14:0/18:4(6Z,9Z,12Z,15Z)) C51H90O6 NQHJUMRUDPWTGZ-SUWUYPOLSA-N -BMDB62452 846.767641004 TG(16:0/15:0/20:1(11Z)) C54H102O6 OLBAIUGFGBJONF-HGUUATKKSA-N -BMDB62453 798.673740618 TG(16:0/14:1(9Z)/18:3(6Z,9Z,12Z)) C51H90O6 NWLCPZZGVVUSFY-RRHUTUDWSA-N -BMDB62454 798.673740618 TG(16:0/14:1(9Z)/18:3(9Z,12Z,15Z)) C51H90O6 LWHJRSZLXRMOAP-YBPFWAPBSA-N -BMDB62455 798.673740618 TG(16:0/18:3(6Z,9Z,12Z)/14:1(9Z)) C51H90O6 HVYMAVYOYHRAHR-VIJIUOEUSA-N -BMDB62456 798.673740618 TG(16:0/18:3(9Z,12Z,15Z)/14:1(9Z)) C51H90O6 OQRLQTYUHSMYBO-XJIKFJTISA-N -BMDB62457 790.705040747 TG(18:0/15:0/14:1(9Z)) C50H94O6 POEMAXWBRPFZKX-PDJUYAFRSA-N -BMDB62459 846.767641004 TG(18:0/15:0/18:1(9Z)) C54H102O6 APVPOBGVVXVJSH-IWRJKWNLSA-N -BMDB62461 846.767641004 TG(20:0/15:0/16:1(9Z)) C54H102O6 HREUUVCMFUGBOQ-FECCDXIYSA-N -BMDB62466 924.814591198 TG(20:0/15:0/22:4(7Z,10Z,13Z,16Z)) C60H108O6 XJUZJPDCZUPASF-KDUWMNDDSA-N -BMDB62467 846.767641004 TG(22:0/15:0/14:1(9Z)) C54H102O6 DZWUIBOQQCZJFO-WAEMFQRBSA-N -BMDB62469 900.814591198 TG(22:0/15:0/18:2(9Z,12Z)) C58H108O6 TZSOCBSSQBBTSS-JODOLNPYSA-N -BMDB62470 898.798941133 TG(22:0/15:0/18:3(6Z,9Z,12Z)) C58H106O6 YTPRVRWPVFSOAL-MHPADUKNSA-N -BMDB62473 924.814591198 TG(22:0/15:0/20:4(5Z,8Z,11Z,14Z)) C60H108O6 OHIGSKGZRDLMSK-KWILIEPASA-N -BMDB62474 952.845891326 TG(22:0/15:0/22:4(7Z,10Z,13Z,16Z)) C62H112O6 RBNFTDLTHUHQJO-VQIGVWRVSA-N -BMDB62475 898.798941133 TG(22:0/15:0/18:3(9Z,12Z,15Z)) C58H106O6 YFTFKGRPESIBQI-FNRWURKDSA-N -BMDB62478 928.845891326 TG(24:0/15:0/18:2(9Z,12Z)) C60H112O6 LDPBQRWCJACJSJ-ZCGDJMIFSA-N -BMDB62479 926.830241262 TG(24:0/15:0/18:3(6Z,9Z,12Z)) C60H110O6 AFRHTXSGJZBJEK-FKZFEJELSA-N -BMDB62481 952.845891326 TG(24:0/15:0/20:4(5Z,8Z,11Z,14Z)) C62H112O6 HVTDRKMNLXBRAC-FWRHJWPXSA-N -BMDB62483 926.830241262 TG(24:0/15:0/18:3(9Z,12Z,15Z)) C60H110O6 ZLHFCDYCFQPFAG-QVXLBHFGSA-N -BMDB62484 924.814591198 TG(24:0/15:0/18:4(6Z,9Z,12Z,15Z)) C60H108O6 VPFZFWBQBROUGP-IWOSBTQLSA-N -BMDB62487 770.642440489 TG(14:1(9Z)/14:0/18:3(6Z,9Z,12Z)) C49H86O6 GNLWEEXSDSFXNJ-HFBGPIEWSA-N -BMDB62489 770.642440489 TG(14:1(9Z)/14:0/18:3(9Z,12Z,15Z)) C49H86O6 HXZOAMZGAUDRLR-ZUMUJTSCSA-N -BMDB62490 776.725776191 TG(14:1(9Z)/15:0/o-18:0) C50H96O5 JHXKWAARTHRGDX-WGIOATGOSA-N -BMDB62491 798.673740618 TG(14:1(9Z)/16:0/18:3(6Z,9Z,12Z)) C51H90O6 WCTQHGKNXPVJMQ-BJOSFJKTSA-N -BMDB62492 798.673740618 TG(14:1(9Z)/16:0/18:3(9Z,12Z,15Z)) C51H90O6 XTRYZGWGRJXOOV-YBPFWAPBSA-N -BMDB62493 744.626790425 TG(14:1(9Z)/14:1(9Z)/16:1(9Z)) C47H84O6 SVKNSUKRPRJLMQ-QSDZTSERSA-N -BMDB62494 770.642440489 TG(14:1(9Z)/14:1(9Z)/18:2(9Z,12Z)) C49H86O6 ZKUXYRGOHVAQTO-GJMMRMLPSA-N -BMDB62496 744.62679042 TG(14:1(9Z)/16:1(9Z)/14:1(9Z)) C47H84O6 UUHFVYROTXJXCR-SASKFMPESA-N -BMDB62497 798.673740618 TG(14:1(9Z)/16:1(9Z)/18:2(9Z,12Z)) C51H90O6 XPYGWWVHYLRURU-PZMZSIAASA-N -BMDB62498 770.642440489 TG(14:1(9Z)/18:2(9Z,12Z)/14:1(9Z)) C49H86O6 DIRRXTMFJOBQJL-HMORJWIESA-N -BMDB62499 798.673740618 TG(14:1(9Z)/18:2(9Z,12Z)/16:1(9Z)) C51H90O6 WJWQEGJNNYAEMU-PZMZSIAASA-N -BMDB62501 798.673740618 TG(16:1(9Z)/14:0/18:3(6Z,9Z,12Z)) C51H90O6 IEMSJARCABXYAI-DSHDAVCZSA-N -BMDB62502 798.673740618 TG(16:1(9Z)/14:0/18:3(9Z,12Z,15Z)) C51H90O6 KHMIUYHHLSILFQ-NGYNEUHUSA-N -BMDB62503 900.814591198 TG(16:1(9Z)/15:0/24:1(15Z)) C58H108O6 BIVVWXVYGHOKIM-BYOZWASUSA-N -BMDB62504 798.673740618 TG(16:1(9Z)/14:1(9Z)/18:2(9Z,12Z)) C51H90O6 ZPZGOYQBHJNTHP-PZMZSIAASA-N -BMDB62508 900.814591198 TG(18:1(9Z)/15:0/22:1(13Z)) C58H108O6 WDEQRGGWWPURTM-JPVYIBRBSA-N -BMDB62509 928.845891326 TG(18:1(9Z)/15:0/24:1(15Z)) C60H112O6 CQHBNHZPQMAQRQ-BVWQVLTHSA-N -BMDB62511 832.788376449 TG(18:1(9Z)/15:0/o-18:0) C54H104O5 FUYXCWQRELQTDS-FEKLXSIDSA-N -BMDB62512 900.814591188 TG(20:1(11Z)/15:0/20:1(11Z)) C58H108O6 PWOMLGILNAAXBL-LBXGSASVSA-N -BMDB62513 928.845891326 TG(20:1(11Z)/15:0/22:1(13Z)) C60H112O6 BHMNYQXXBGBVQM-RQOLIHFSSA-N -BMDB62518 984.908491584 TG(22:1(13Z)/15:0/24:1(15Z)) C64H120O6 ZESOFCBMWKPOCB-IRVPXVQWSA-N -BMDB62519 898.798941133 TG(22:1(13Z)/15:0/18:2(9Z,12Z)) C58H106O6 ZMLPYXDICDGROD-BQIKIWBJSA-N -BMDB62523 926.830241262 TG(24:1(15Z)/15:0/18:2(9Z,12Z)) C60H110O6 JJKFGVCMRIJWBI-ZMHWGGBRSA-N -BMDB62524 924.814591198 TG(24:1(15Z)/15:0/18:3(6Z,9Z,12Z)) C60H108O6 ABBJVEBAFLLCTN-UHCIUADBSA-N -BMDB62528 924.814591198 TG(24:1(15Z)/15:0/18:3(9Z,12Z,15Z)) C60H108O6 IROOPZMKLWWAJR-LBVZHLKQSA-N -BMDB62532 140.047344122 "Ethyl furoate" C7H8O3 NHXSTXWKZVAVOQ-UHFFFAOYSA-N -BMDB62533 245.148789499 beta-Alanyl-L-arginine C9H19N5O3 DLRGFJGVZXSSTP-LURJTMIESA-N -BMDB62534 238.050782583 Uranium U JFALSRSLKYAFGM-UHFFFAOYSA-N -BMDB62535 226.193280077 "9E-tetradecenoic acid" C14H26O2 YWWVWXASSLXJHU-AATRIKPKSA-N -BMDB62536 161.068807845 "N-methyl-L-glutamic Acid" C6H11NO4 XLBVNMSMFQMKEY-BYPYZUCNSA-N -BMDB62537 174.100442324 N(5)-ethyl-L-glutamine C7H14N2O3 DATAGRPVKZEWHA-YFKPBYRVSA-N -BMDB62538 282.255880335 "13Z-Octadecenoic acid" C18H34O2 BDLLSHRIFPDGQB-WAYWQWQTSA-N -BMDB62540 128.004433931 2-Thiouracil C4H4N2OS ZEMGGZBWXRYJHK-UHFFFAOYSA-N -BMDB62541 128.035316637 4-Oxoproline C5H6NO3 HFXAFXVXPMUQCQ-UHFFFAOYSA-M -BMDB62542 498.37091009 "7,11-Dioxolanost-8-en-3-yl acetate" C32H50O4 MMVITYGCRCBTDU-UHFFFAOYSA-N -BMDB62548 280.24023027 "9Z,15Z-octadecadienoic acid" C18H32O2 AWGFYZFANDHELM-RTAKVZRXSA-N -BMDB62549 307.153206168 Ala-Phe-Ala C15H21N3O4 XRUJOVRWNMBAAA-UHFFFAOYSA-N -BMDB62550 486.313897752 Arg-Arg-Arg C18H38N12O4 XPSGESXVBSQZPL-UHFFFAOYSA-N -BMDB62551 559.355428213 Arg-Thr-Lys-Arg C22H45N11O6 UPLCTTWJNCYYAW-UHFFFAOYSA-N -BMDB62552 472.275780911 Asn-Arg-Ala-Ile C19H36N8O6 SVSBLOSMLPLILN-UHFFFAOYSA-N -BMDB62553 310.287180464 "C20:1 c5" C20H38O2 FPAQLJHSZVFKES-NXVVXOECSA-N -BMDB62554 343.085460224 "Coenzyme B" C11H22NO7PS JBJSVEVEEGOEBZ-UHFFFAOYSA-N -BMDB62555 162.052823422 "Conduritol B epoxide" C6H10O5 ZHMWOVGZCINIHW-FTYOSCRSSA-N -BMDB62556 436.108641477 Cys-Cys-Asp-Pro C15H24N4O7S2 DKZZUBANFHKYBC-UHFFFAOYSA-N -BMDB62557 188.104859 "Ethyl glutarate" C9H16O4 OUWSNHWQZPEFEX-UHFFFAOYSA-N -BMDB62558 43.017047044 Hydrogen-azide HN3 JUINSXZKUKVTMD-UHFFFAOYSA-N -BMDB62559 454.315520468 Ile-Ile-Ile-Pro C23H42N4O5 OCEZPDBEDULORM-UHFFFAOYSA-N -BMDB62560 329.23145649 Ile-Val-Val C16H31N3O4 YHFPHRUWZMEOIX-UHFFFAOYSA-N -BMDB62561 278.224580206 "Jacaric acid" C18H30O2 DQGMPXYVZZCNDQ-KDQYYBQISA-N -BMDB62562 557.339778149 Leu-Arg-Asn-Arg C22H43N11O6 PFUDAVBUJIYNMF-UHFFFAOYSA-N -BMDB62563 513.363867641 Leu-Arg-Leu-Ile C24H47N7O5 UEEBGIUHABTYMD-UHFFFAOYSA-N -BMDB62564 407.242021175 Leu-Leu-Tyr C21H33N3O5 UCNNZELZXFXXJQ-BZSNNMDCSA-N -BMDB62565 341.23145649 Leu-Pro-Ile C17H31N3O4 YUTNOGOMBNYPFH-UHFFFAOYSA-N -BMDB62566 424.195799258 Lys-Asp-Tyr C19H28N4O7 NTBFKPBULZGXQL-KKUMJFAQSA-N -BMDB62567 95.988114684 "Methanesulfonic acid" CH4O3S AFVFQIVMOAPDHO-UHFFFAOYSA-N -BMDB62569 410.31445784 "N-oleoyl glutamine" C23H42N2O4 ZHVSXWCIYWYBQP-QJRAZLAKSA-N -BMDB62570 219.074287153 O-Succinyl-L-homoserine C8H13NO6 GNISQJGXJIDKDJ-YFKPBYRVSA-N -BMDB62571 565.301267384 Phe-Phe-Pro-Arg C29H39N7O5 ANAFHSULEWIOPZ-UHFFFAOYSA-N -BMDB62572 375.215806426 Phe-Pro-Ile C20H29N3O4 FZBGMXYQPACKNC-UHFFFAOYSA-N -BMDB62573 227.079372523 Pretyrosine C10H13NO5 MIEILDYWGANZNH-DSQUFTABSA-N -BMDB62574 228.147392512 Pro-Ile C11H20N2O3 OCYROESYHWUPBP-CIUDSAMLSA-N -BMDB62575 359.184506297 Pro-Pro-Phe C19H25N3O4 NAIPAPCKKRCMBL-UHFFFAOYSA-N -BMDB62576 158.92535 Terbium Tb GZCRRIHWUXGPOV-UHFFFAOYSA-N -BMDB62577 526.27913496 Val-Phe-Val-Tyr C28H38N4O6 HRJFPLCYTCOZOV-UHFFFAOYSA-N -BMDB62578 311.184506297 Val-Pro-Pro C15H25N3O4 DOFAQXCYFQKSHT-SRVKXCTJSA-N -BMDB62579 229.240564622 "Xestoaminol C" C14H31NO WMUMHAZHWIUBPN-UONOGXRCSA-N -BMDB62580 180.063388106 alpha-D-Allofuranose C6H12O6 AVVWPBAENSWJCB-RXRWUWDJSA-N -BMDB62581 278.224580206 "beta-Calendic acid" C18H30O2 DQGMPXYVZZCNDQ-OBWVEWQSSA-N -BMDB62583 188.032087988 homo-cis-Aconitate C7H8O6 BJYPZFUWWJSAKC-ARJAWSKDSA-N -BMDB62584 549.327482133 Val-Tyr-Leu-Arg C26H43N7O6 PQXJRCMPKACZNI-UHFFFAOYSA-N -BMDB62585 226.193280077 "3E-tetradecenoic acid" C14H26O2 KYQLBACAKNAOOC-VAWYXSNFSA-N -BMDB62586 226.193280076 "Physeteric acid" C14H26O2 AFGUVBVUFZMJMX-KTKRTIGZSA-N -BMDB62587 226.193280077 "7Z-tetradecenoic acid" C14H26O2 ZVXDGKJSUPWREP-FPLPWBNLSA-N -BMDB62588 254.224580204 "Lycopodic acid" C16H30O2 JGMYDQCXGIMHLL-AATRIKPKSA-N -BMDB62589 254.224580206 "11Z-hexadecenoic acid" C16H30O2 JGMYDQCXGIMHLL-WAYWQWQTSA-N -BMDB62590 254.224580206 "5Z-hexadecenoic acid" C16H30O2 KVXIRQZWCOAYRD-QXMHVHEDSA-N -BMDB62591 268.24023027 "10E-heptadecenoic acid" C17H32O2 GDTXICBNEOEPAZ-BQYQJAHWSA-N -BMDB62592 268.24023027 "8E-heptadecenoic acid" C17H32O2 ZBIGLIMGCLJKHN-MDZDMXLPSA-N -BMDB62593 268.24023027 "Civetic acid" C17H32O2 ZBIGLIMGCLJKHN-KTKRTIGZSA-N -BMDB62594 308.271530399 "7Z,14Z-eicosadienoic acid" C20H36O2 LYJCLHKKCLWCLC-ZBXVJARNSA-N -BMDB62595 383.267173295 (5Z,8Z)-3-Hydroxytetradecadienoylcarnitine C21H37NO5 LVNITLZCNUEXQK-UTJQPWESSA-N -BMDB62597 441.345423617 (9Z)-3-Hydroxyoctadecenoylcarnitine C25H47NO5 YBCVTTMMURGSEY-SEYXRHQNSA-N -BMDB62598 411.298473424 (9Z,12Z)-3-Hydroxyhexadecadienoylcarnitine C23H41NO5 CPHHQDCIGLXPCO-NQLNTKRDSA-N -BMDB62599 624.584531676 "16:0 Cholesteryl ester" C43H76O2 BBJQPKLGPMQWBU-JADYGXMDSA-N -BMDB62600 650.60018174 "18:1 Cholesteryl ester" C45H78O2 RJECHNNFRHZQKU-RMUVNZEASA-N -BMDB62601 648.584531676 "18:2 Cholesteryl ester" C45H76O2 NAACPBBQTFFYQB-LJAITQKLSA-N -BMDB62602 243.14705816 2-Ethylacryloylcarnitine C12H21NO4 AUFJTEGVQXGXTG-UHFFFAOYSA-N -BMDB62603 670.568881623 "20:5 Cholesteryl ester" C47H74O2 XZFUGMCJZFRBKF-BDJFIEMMSA-N -BMDB62604 698.600181752 "22:5 Cholesteryl ester" C49H78O2 XOLZNHXNFMEUGA-DCDLNIKOSA-N -BMDB62605 247.14197278 3-Hydroxybutyrylcarnitine C11H21NO5 UEFRDQSMQXDWTO-UHFFFAOYSA-N -BMDB62606 203.115758031 Acetyl-D-carnitine C9H17NO4 RDHQFKQIGNGIED-QMMMGPOBSA-N -BMDB62607 566.491025225 DG(12:0/20:1(11Z)/0:0)[iso2] C35H66O5 FWHSISWHFVYSNM-WZCSSZMCSA-N -BMDB62608 564.475375161 DG(12:0/20:2(11Z,14Z)/0:0)[iso2] C35H64O5 ROMBWMLCYZZIBF-JXLXOFGUSA-N -BMDB62609 566.491025222 DG(14:0/18:1(9Z)/0:0)[iso2] C35H66O5 XEQQGHISHUGMIP-ASUORMEESA-N -BMDB62610 564.475375158 DG(14:0/18:2(9Z,12Z)/0:0)[iso2] C35H64O5 WVBVUWWRPSWGDS-JWVBYZEHSA-N -BMDB62611 594.52232535 DG(14:0/20:1(11Z)/0:0)[iso2] C37H70O5 VQOIASKPUKUIDV-CEJFXXFTSA-N -BMDB62612 590.491025222 DG(14:0/20:3(8Z,11Z,14Z)/0:0)[iso2] C37H66O5 MIOCZRAJMXIEKP-NYBWPXJJSA-N -BMDB62613 566.491025222 DG(14:1(9Z)/18:0/0:0)[iso2] C35H66O5 PAHKOLCUPPSBEU-ZUMVFQCASA-N -BMDB62614 564.475375158 DG(14:1(9Z)/18:1(9Z)/0:0)[iso2] C35H64O5 HJBMLXDFAMFHQW-QGYSHCINSA-N -BMDB62615 594.52232535 DG(14:1(9Z)/20:0/0:0)[iso2] C37H70O5 MTIPZYJQFUTOHS-UPROKQPWSA-N -BMDB62616 590.491025222 DG(14:1(9Z)/20:2(11Z,14Z)/0:0)[iso2] C37H66O5 YMQRUULVAHFQLL-MJRSHOOBSA-N -BMDB62617 566.491025222 DG(16:0/16:1(9Z)/0:0)[iso2] C35H66O5 ADLOEVQMJKYKSR-YAIMUBSCSA-N -BMDB62618 590.491025222 DG(16:0/18:3(9Z,12Z,15Z)/0:0)[iso2] C37H66O5 UHPKYXAUVQOHQL-DSZXWZEOSA-N -BMDB62619 620.537975414 DG(16:0/20:2(11Z,14Z)/0:0)[iso2] C39H72O5 MVAYIPZWUCBXOE-PKQDJGPXSA-N -BMDB62620 618.52232535 DG(16:0/20:3(8Z,11Z,14Z)/0:0)[iso2] C39H70O5 XYIQDUUJTXPBFG-JKUSIIDJSA-N -BMDB62621 652.60057567 DG(16:0/22:0/0:0)[iso2] C41H80O5 JAJNYVORAKCQCM-KDXMTYKHSA-N -BMDB62622 594.52232535 DG(16:1(9Z)/18:0/0:0)[iso2] C37H70O5 SPBROLJVHYTNGF-BSNNDZOISA-N -BMDB62623 590.491025222 DG(16:1(9Z)/18:2(9Z,12Z)/0:0)[iso2] C37H66O5 BHGPPCIWDXQOMA-IXDOJJAKSA-N -BMDB62624 620.537975414 DG(16:1(9Z)/20:1(11Z)/0:0)[iso2] C39H72O5 FBCDXXQBGHZSLI-JSTCSLLMSA-N -BMDB62625 618.52232535 DG(16:1(9Z)/20:2(11Z,14Z)/0:0)[iso2] C39H70O5 WPAJXHHVSWVZKN-YCGDJTGESA-N -BMDB62626 652.600575676 DG(17:0/21:0/0:0)[iso2] C41H80O5 UBMVHLXKTLMMJU-KDXMTYKHSA-N -BMDB62627 666.61622574 DG(17:0/22:0/0:0)[iso2] C42H82O5 OXOSWOLENAISIR-FAIXQHPJSA-N -BMDB62628 620.537975414 DG(18:0/18:2(9Z,12Z)/0:0)[iso2] C39H72O5 AJMZUFBKADIAKC-SKTOPKGQSA-N -BMDB62629 618.52232535 DG(18:0/18:3(9Z,12Z,15Z)/0:0)[iso2] C39H70O5 UBECYQFWKVVULW-RSUCNCGHSA-N -BMDB62630 652.60057567 DG(18:0/20:0/0:0)[iso2] C41H80O5 JPKVDETWOQEHQO-KDXMTYKHSA-N -BMDB62631 666.61622574 DG(18:0/21:0/0:0)[iso2] C42H82O5 RJBJDNUTASYQLX-FAIXQHPJSA-N -BMDB62632 594.522325354 DG(18:1(11E)/16:0/0:0) C37H70O5 GSEVZLBSIOIEFK-AAOCECEDSA-N -BMDB62633 618.52232535 DG(18:1(9Z)/18:2(9Z,12Z)/0:0)[iso2] C39H70O5 BLZVZPYMHLXLHG-JOBMVARSSA-N -BMDB62634 590.491025222 DG(18:3(6Z,9Z,12Z)/16:0/0:0)[iso2] C37H66O5 NFVDEXJHCNKRNB-XEQVECQLSA-N -BMDB62635 618.52232535 DG(18:3(6Z,9Z,12Z)/18:0/0:0)[iso2] C39H70O5 ZPHRNEDMZVPDPW-CBKFDAJOSA-N -BMDB62636 652.600575676 DG(19:0/19:0/0:0) C41H80O5 UNXQXIYZHULSKR-KDXMTYKHSA-N -BMDB62637 666.61622574 DG(19:0/20:0/0:0)[iso2] C42H82O5 WOYQNYWDHIPWIB-FAIXQHPJSA-N -BMDB62638 692.631875805 DG(19:0/22:1(13Z)/0:0)[iso2] C44H84O5 SECFFWQDXUWKND-ZMKUDAGUSA-N -BMDB62639 708.663175926 DG(20:0/22:0/0:0)[iso2] C45H88O5 FASMRHWOTINWGZ-QLKFWGTOSA-N -BMDB62640 706.647525862 DG(20:0/22:1(13Z)/0:0)[iso2] C45H86O5 DSCILNRDAOLXET-URFWVIAFSA-N -BMDB62641 692.631875805 DG(20:1(11Z)/21:0/0:0)[iso2] C44H84O5 JBZLTWGWTHFDEQ-KXXNDPJKSA-N -BMDB62642 706.647525862 DG(20:1(11Z)/22:0/0:0)[iso2] C45H86O5 KKUJWTOLSKTBLP-QGWKGAMHSA-N -BMDB62643 704.631875798 DG(20:1(11Z)/22:1(13Z)/0:0)[iso2] C45H84O5 TXSPVVDGQJIPFG-ALXJKLDESA-N -BMDB62644 704.631875798 DG(20:2(11Z,14Z)/22:0/0:0)[iso2] C45H84O5 KVPLVJYCAJVIFI-WSVMHZSVSA-N -BMDB62645 708.663175934 DG(21:0/21:0/0:0) C45H88O5 PALXRFBPSNIFEK-QLKFWGTOSA-N -BMDB62646 580.543060798 DG(O-16:0/18:1(9Z)) C37H72O4 ZDRGKGZHXIWXJD-MEVCPPAWSA-N -BMDB62647 203.115758037 DL-Acetylcarnitine C9H17NO4 RDHQFKQIGNGIED-UHFFFAOYSA-N -BMDB62648 245.162708225 Isovaleryl-L-carnitine C12H23NO4 IGQBPDJNUXPEMT-SNVBAGLBSA-N -BMDB62650 261.121237345 Methylmalonylcarnitine C11H19NO6 XROYFEWIXXCPAW-MQWKRIRWSA-N -BMDB62651 289.152537473 O-Adipoylcarnitine C13H23NO6 BSVHAXJKBCWVDA-UHFFFAOYSA-N -BMDB62652 343.272258675 O-Dodecanoylcarnitine C19H37NO4 FUJLYHJROOYKRA-UHFFFAOYSA-N -BMDB62654 261.121237336 O-Methylmalonylcarnitine C11H19NO6 XROYFEWIXXCPAW-UHFFFAOYSA-N -BMDB62655 217.131408096 O-Propanoyl-D-carnitine C10H19NO4 UFAHZIUFPNSHSL-QMMMGPOBSA-N -BMDB62656 261.121237345 O-Succinylcarnitine C11H19NO6 HAEVNYBCYZZDFL-UHFFFAOYSA-N -BMDB62657 371.303558804 O-Tetradecanoylcarnitine C21H41NO4 PSHXNVGSVNEJBD-UHFFFAOYSA-N -BMDB62662 675.483905216 PC(10:0/18:1(9Z)) C36H70NO8P LHGRLARXULFYPW-RZCWWDNZSA-N -BMDB62663 691.515205345 PC(10:0/19:0) C37H74NO8P UPBDHGWIURTORP-PGUFJCEWSA-N -BMDB62664 705.530855409 PC(10:0/20:0) C38H76NO8P SVIWSHKAEXRJFD-PSXMRANNSA-N -BMDB62665 719.546505474 PC(10:0/21:0) C39H78NO8P QIPBUWAWTWBGPP-DIPNUNPCSA-N -BMDB62666 733.562155538 PC(10:0/22:0) C40H80NO8P IOFVELCSFOVZPC-KXQOOQHDSA-N -BMDB62667 747.577805602 PC(10:0/23:0) C41H82NO8P RCFPRPKUCWXQNV-LDLOPFEMSA-N -BMDB62668 761.593455667 PC(10:0/24:0) C42H84NO8P KMJHXPMCMOXODU-RRHRGVEJSA-N -BMDB62669 705.530855409 PC(11:0/19:0) C38H76NO8P QEJBTEZRLKJPKT-PSXMRANNSA-N -BMDB62670 719.546505474 PC(11:0/20:0) C39H78NO8P OELOTERACVRIQH-DIPNUNPCSA-N -BMDB62671 733.562155538 PC(11:0/21:0) C40H80NO8P SFHLFLGTWUXKDJ-KXQOOQHDSA-N -BMDB62672 747.577805602 PC(11:0/22:0) C41H82NO8P LDFNJDAPTPJKTN-LDLOPFEMSA-N -BMDB62673 761.593455667 PC(11:0/23:0) C42H84NO8P ARPFEYKJAOELFX-RRHRGVEJSA-N -BMDB62674 775.609105731 PC(11:0/24:0) C43H86NO8P WSIRPZLICLQFIR-VQJSHJPSSA-N -BMDB62675 675.483904733 PC(12:0/16:1(9Z)) C36H70NO8P YTBUBHOCZIYJCN-ALNMSFLZSA-N -BMDB62676 691.515205345 PC(12:0/17:0) C37H74NO8P UHQZAGLLHJLILZ-PGUFJCEWSA-N -BMDB62677 705.530855409 PC(12:0/18:0) C38H76NO8P XMMPMEPNQVLMLI-PSXMRANNSA-N -BMDB62678 703.515205345 PC(12:0/18:1(9Z)) C38H74NO8P LPUZRKCOBURCPA-UAIAYBLDSA-N -BMDB62679 719.546505474 PC(12:0/19:0) C39H78NO8P WMOFTJILTZIKIH-DIPNUNPCSA-N -BMDB62680 733.562155053 PC(12:0/20:0) C40H80NO8P UZNWSMIOMFUEDK-KXQOOQHDSA-N -BMDB62681 731.546505474 PC(12:0/20:1(11Z)) C40H78NO8P BUFPMOFUFXIVNG-YWTUKGCKSA-N -BMDB62682 729.530854925 PC(12:0/20:2(11Z,14Z)) C40H76NO8P IABPRJCFINAMLD-JSHIBXJCSA-N -BMDB62683 727.515205345 PC(12:0/20:3(8Z,11Z,14Z)) C40H74NO8P KSFNDKKWDZYJSF-XDBAXXFZSA-N -BMDB62684 747.577805602 PC(12:0/21:0) C41H82NO8P VQFNJMUDCGKGQK-LDLOPFEMSA-N -BMDB62685 761.593455667 PC(12:0/22:0) C42H84NO8P WFNYHLJLDCXMDV-RRHRGVEJSA-N -BMDB62686 753.530855409 PC(12:0/22:4(7Z,10Z,13Z,16Z)) C42H76NO8P YOKRROJLYKOJNI-SRHQVDMPSA-N -BMDB62687 775.609105731 PC(12:0/23:0) C43H86NO8P JYMIPWOZASSGGM-VQJSHJPSSA-N -BMDB62688 789.624755796 PC(12:0/24:0) C44H88NO8P IIKFGPGQHMMADZ-HUESYALOSA-N -BMDB62689 691.515205345 PC(13:0/16:0) C37H74NO8P GYPKSXNFKICCOR-PGUFJCEWSA-N -BMDB62690 705.530855409 PC(13:0/17:0) C38H76NO8P AZEAMUNCULVBPK-PSXMRANNSA-N -BMDB62691 719.546505474 PC(13:0/18:0) C39H78NO8P JCYHLCNGJZYTHB-DIPNUNPCSA-N -BMDB62692 717.530855409 PC(13:0/18:1(9Z)) C39H76NO8P JLKJDPHPYLQTAM-PLOGQBHYSA-N -BMDB62693 715.515205345 PC(13:0/18:2(9Z,12Z)) C39H74NO8P VYIZOJIGQOJWGL-HFWMYYSASA-N -BMDB62694 733.562155538 PC(13:0/19:0) C40H80NO8P CXQDKCMMOXUQLJ-KXQOOQHDSA-N -BMDB62695 747.577805602 PC(13:0/20:0) C41H82NO8P STFDYQJAZCASBW-LDLOPFEMSA-N -BMDB62696 745.562155538 PC(13:0/20:1(11Z)) C41H80NO8P HILNHYCWLDRSKJ-DPTAKULKSA-N -BMDB62697 743.546505474 PC(13:0/20:2(11Z,14Z)) C41H78NO8P QHOURZDLKBFDGQ-ZSIBMOKUSA-N -BMDB62698 761.593455667 PC(13:0/21:0) C42H84NO8P YNAVPMYVEPIOMV-RRHRGVEJSA-N -BMDB62699 775.609105731 PC(13:0/22:0) C43H86NO8P QASAKYKIYWSVDC-VQJSHJPSSA-N -BMDB62700 789.624755796 PC(13:0/23:0) C44H88NO8P KMWAIMBDGYWJJR-HUESYALOSA-N -BMDB62701 719.546505474 PC(14:0/17:0) C39H78NO8P XVICSSKXVFMPSZ-DIPNUNPCSA-N -BMDB62702 747.577805602 PC(14:0/19:0) C41H82NO8P LQBNSMVVDPMRST-LDLOPFEMSA-N -BMDB62703 775.609105731 PC(14:0/21:0) C43H86NO8P ZAEASCYIFCXOFJ-VQJSHJPSSA-N -BMDB62704 717.530855409 PC(14:1(9Z)/17:0) C39H76NO8P UWZMQXDPMXICQP-IEHWZJNJSA-N -BMDB62705 745.562155538 PC(14:1(9Z)/19:0) C41H80NO8P XUJPXXPURAZXIE-DTKYWWSASA-N -BMDB62706 773.593455667 PC(14:1(9Z)/21:0) C43H84NO8P APGJPFHCNZZTPN-XTSQRIEGSA-N -BMDB62708 733.562155538 PC(15:0/17:0) C40H80NO8P CAGAUSXUXQQKRC-KXQOOQHDSA-N -BMDB62709 761.593455667 PC(15:0/19:0) C42H84NO8P YVCPDSWUXVQBNE-RRHRGVEJSA-N -BMDB62710 789.624755796 PC(15:0/21:0) C44H88NO8P VWLICNQRTMDGNI-HUESYALOSA-N -BMDB62712 691.515205345 PC(16:0/13:0) C37H74NO8P JTPYLSOQEHJKNH-PGUFJCEWSA-N -BMDB62713 747.577805602 PC(16:0/17:0) C41H82NO8P CNHYMCCAIZQMPA-LDLOPFEMSA-N -BMDB62714 759.577805602 PC(16:0/18:1(11E)) C42H82NO8P AEPVLLKGEBHLEJ-CRZTYIBISA-N -BMDB62715 759.577805602 PC(16:0/18:1(9E)) C42H82NO8P WTJKGGKOPKCXLL-RYDYYDTQSA-N -BMDB62716 757.562155538 PC(16:0/18:2(9E,12E)) C42H80NO8P JLPULHDHAOZNQI-JLOPVYAASA-N -BMDB62717 775.609105731 PC(16:0/19:0) C43H86NO8P DRHYTKZTKWDSBJ-VQJSHJPSSA-N -BMDB62718 803.64040586 PC(16:0/21:0) C45H90NO8P MLFCBZAXKCJVAK-VZUYHUTRSA-N -BMDB62719 675.483904733 PC(16:1(9Z)/12:0) C36H70NO8P NEMULSNXBUKEGX-ALNMSFLZSA-N -BMDB62720 745.562155538 PC(16:1(9Z)/17:0) C41H80NO8P OFRWLQSOUIZELQ-VEAYGOGPSA-N -BMDB62721 773.593455667 PC(16:1(9Z)/19:0) C43H84NO8P BKOVIRNFTBFFRO-HVLKLTLRSA-N -BMDB62722 691.515205345 PC(17:0/12:0) C37H74NO8P FKXLGHWVLBZNMB-PGUFJCEWSA-N -BMDB62723 705.530855409 PC(17:0/13:0) C38H76NO8P WCVPTHRKFPAKIN-PSXMRANNSA-N -BMDB62724 719.546505474 PC(17:0/14:0) C39H78NO8P JSYFGYWOHKUBJD-DIPNUNPCSA-N -BMDB62725 717.530855409 PC(17:0/14:1(9Z)) C39H76NO8P PLMJQEBGYPYWCL-IEHWZJNJSA-N -BMDB62726 733.562155538 PC(17:0/15:0) C40H80NO8P LOLPCAJPUJWKHZ-KXQOOQHDSA-N -BMDB62727 747.577805602 PC(17:0/16:0) C41H82NO8P ULRGYXXISKXLRY-LDLOPFEMSA-N -BMDB62728 745.562155538 PC(17:0/16:1(9Z)) C41H80NO8P DISVYZNGGMDUPX-VEAYGOGPSA-N -BMDB62729 761.593455667 PC(17:0/17:0) C42H84NO8P RTWAYAIMWLNAJW-RRHRGVEJSA-N -BMDB62730 775.609105731 PC(17:0/18:0) C43H86NO8P YJWIMUXYXBHXDA-VQJSHJPSSA-N -BMDB62731 773.593455667 PC(17:0/18:1(9Z)) C43H84NO8P SXNXGNVZTLZDHE-IYEJTHTFSA-N -BMDB62732 771.577805602 PC(17:0/18:2(9Z,12Z)) C43H82NO8P ZSKWZJYUVZYDQU-WESJWMGVSA-N -BMDB62733 769.562155538 PC(17:0/18:3(6Z,9Z,12Z)) C43H80NO8P FRGPJGOCQLYORI-LKMVIVGJSA-N -BMDB62734 769.562155538 PC(17:0/18:3(9Z,12Z,15Z)) C43H80NO8P JWRXJXZFMNQZBD-CAPSFDDTSA-N -BMDB62735 789.624755796 PC(17:0/19:0) C44H88NO8P YTOAPAUFDPDITM-HUESYALOSA-N -BMDB62736 803.64040586 PC(17:0/20:0) C45H90NO8P DUHNELFGOVIVQQ-VZUYHUTRSA-N -BMDB62738 757.562155538 PC(17:1(10Z)/17:1(10Z)) C42H80NO8P IPVXFAFRWUVOLG-JSLHZOBYSA-N -BMDB62740 705.530855409 PC(18:0/12:0) C38H76NO8P BRNGDJBMPAYDPP-PSXMRANNSA-N -BMDB62741 719.546505474 PC(18:0/13:0) C39H78NO8P MBVGMFMZJMLHCN-DIPNUNPCSA-N -BMDB62742 775.609105731 PC(18:0/17:0) C43H86NO8P INGHVKLNPWCPOK-VQJSHJPSSA-N -BMDB62743 787.609105731 PC(18:0/18:1(9E)) C44H86NO8P ATHVAWFAEPLPPQ-QPOMNCEOSA-N -BMDB62744 803.64040586 PC(18:0/19:0) C45H90NO8P IFJJJCCHAXWTHR-VZUYHUTRSA-N -BMDB62745 785.593455667 PC(18:1(11E)/18:1(11E)) C44H84NO8P XUCDYRWWRZBNCQ-MFLKKAITSA-N -BMDB62747 785.593455667 PC(18:1(9E)/18:1(9E)) C44H84NO8P SNKAWJBJQDLSFF-PKSSMFHRSA-N -BMDB62749 703.515205345 PC(18:1(9Z)/12:0) C38H74NO8P KVJSTSHUTARPIN-UAIAYBLDSA-N -BMDB62750 717.530855409 PC(18:1(9Z)/13:0) C39H76NO8P IGTKDXNVLGHPAA-PLOGQBHYSA-N -BMDB62751 773.593455667 PC(18:1(9Z)/17:0) C43H84NO8P MFHIZGSSDZJFKD-IYEJTHTFSA-N -BMDB62753 715.515205345 PC(18:2(9Z,12Z)/13:0) C39H74NO8P RFJWWQWWVQESGK-HFWMYYSASA-N -BMDB62754 771.577805602 PC(18:2(9Z,12Z)/17:0) C43H82NO8P MJWAVUYQCBFFHQ-WESJWMGVSA-N -BMDB62755 811.609105731 PC(18:2(9Z,12Z)/20:1(13Z)) C46H86NO8P VQHXLFJRJYRJKV-IIRKCDRKSA-N -BMDB62756 769.562155538 PC(18:3(6Z,9Z,12Z)/17:0) C43H80NO8P PUHAYEBYJPOIQY-MZWPLUPDSA-N -BMDB62757 769.562155538 PC(18:3(9Z,12Z,15Z)/17:0) C43H80NO8P GCHJOKRHLDGHKV-CAPSFDDTSA-N -BMDB62758 691.515205345 PC(19:0/10:0) C37H74NO8P KPRFWGHYCQLGIB-PGUFJCEWSA-N -BMDB62759 705.530855409 PC(19:0/11:0) C38H76NO8P CLIZQKAVTJPDEN-PSXMRANNSA-N -BMDB62760 719.546505474 PC(19:0/12:0) C39H78NO8P DXWQYRCWRLUKOS-DIPNUNPCSA-N -BMDB62761 733.562155538 PC(19:0/13:0) C40H80NO8P DKJFFVQSQABKEK-KXQOOQHDSA-N -BMDB62762 747.577805602 PC(19:0/14:0) C41H82NO8P ICFUPYGUNPVSGP-LDLOPFEMSA-N -BMDB62763 745.562155538 PC(19:0/14:1(9Z)) C41H80NO8P GOHYYOQGBYBAOF-DTKYWWSASA-N -BMDB62764 761.593455667 PC(19:0/15:0) C42H84NO8P UPCIYBKCVDLVKU-RRHRGVEJSA-N -BMDB62765 775.609105731 PC(19:0/16:0) C43H86NO8P RVFNLUBQFSKSDF-VQJSHJPSSA-N -BMDB62766 773.593455667 PC(19:0/16:1(9Z)) C43H84NO8P TYYCWWRIQSAMHL-HVLKLTLRSA-N -BMDB62767 789.624755796 PC(19:0/17:0) C44H88NO8P OQLHGHFYLRSIBN-HUESYALOSA-N -BMDB62768 803.64040586 PC(19:0/18:0) C45H90NO8P BRXGZTCFEWZBRM-VZUYHUTRSA-N -BMDB62770 705.530855409 PC(20:0/10:0) C38H76NO8P MTTZRTHCTZNGFG-PSXMRANNSA-N -BMDB62771 719.546505474 PC(20:0/11:0) C39H78NO8P NLEPZIUGLKQAFD-DIPNUNPCSA-N -BMDB62772 733.562155053 PC(20:0/12:0) C40H80NO8P OEKBHTCWCOFVKC-KXQOOQHDSA-N -BMDB62773 747.577805602 PC(20:0/13:0) C41H82NO8P CJNXCVHAGWTVKV-LDLOPFEMSA-N -BMDB62774 803.64040586 PC(20:0/17:0) C45H90NO8P NQDMCNOOWGQYBO-VZUYHUTRSA-N -BMDB62775 839.64040586 PC(20:0/20:3(11Z,14Z,17Z)) C48H90NO8P REABNEVSLLNWCN-NEUZZYPFSA-N -BMDB62776 691.515205345 PC(20:0/9:0) C37H74NO8P YTMYGNSSWREFBW-PGUFJCEWSA-N -BMDB62777 731.546505474 PC(20:1(11Z)/12:0) C40H78NO8P XIRHBJHIIUMUKR-YWTUKGCKSA-N -BMDB62778 745.562155538 PC(20:1(11Z)/13:0) C41H80NO8P FOVVQGVAJUZWET-DPTAKULKSA-N -BMDB62780 729.530854925 PC(20:2(11Z,14Z)/12:0) C40H76NO8P ADIAWBPVWHYXNV-JSHIBXJCSA-N -BMDB62781 743.546505474 PC(20:2(11Z,14Z)/13:0) C41H78NO8P GYFILLBYNRTMGU-ZSIBMOKUSA-N -BMDB62782 727.515205345 PC(20:3(8Z,11Z,14Z)/12:0) C40H74NO8P IVCMKVDNISHOEW-XDBAXXFZSA-N -BMDB62783 781.562155538 PC(20:4(8E,11E,14E,17E)/16:0) C44H80NO8P JWAPTBDWCHGPTG-JQQBZAOGSA-N -BMDB62784 719.546505474 PC(21:0/10:0) C39H78NO8P FXZOHFRKKZKXPD-DIPNUNPCSA-N -BMDB62785 733.562155538 PC(21:0/11:0) C40H80NO8P NRPOMZRRLOEOKX-KXQOOQHDSA-N -BMDB62786 747.577805602 PC(21:0/12:0) C41H82NO8P ZEQNNYKWRFDTGA-LDLOPFEMSA-N -BMDB62787 761.593455667 PC(21:0/13:0) C42H84NO8P LVVWZXOZKXLVLZ-RRHRGVEJSA-N -BMDB62788 775.609105731 PC(21:0/14:0) C43H86NO8P ALLHTRSITKAMHF-VQJSHJPSSA-N -BMDB62789 773.593455667 PC(21:0/14:1(9Z)) C43H84NO8P JLMJHJHQZIEXTR-XTSQRIEGSA-N -BMDB62790 789.624755796 PC(21:0/15:0) C44H88NO8P GAYMLEAVRJPZQZ-HUESYALOSA-N -BMDB62791 803.64040586 PC(21:0/16:0) C45H90NO8P VCWGWIAETRVTSS-VZUYHUTRSA-N -BMDB62793 733.562155538 PC(22:0/10:0) C40H80NO8P VSXSGSFCMUCJEP-KXQOOQHDSA-N -BMDB62794 747.577805602 PC(22:0/11:0) C41H82NO8P UDZHTHXFNTYZET-LDLOPFEMSA-N -BMDB62795 761.593455667 PC(22:0/12:0) C42H84NO8P MCNGJGRPYKOAMP-RRHRGVEJSA-N -BMDB62796 775.609105731 PC(22:0/13:0) C43H86NO8P JXUNNMKLYVGIJB-VQJSHJPSSA-N -BMDB62797 753.530855409 PC(22:4(7Z,10Z,13Z,16Z)/12:0) C42H76NO8P MGGLQCYIGIKUIE-SRHQVDMPSA-N -BMDB62798 691.515205345 PC(8:0/21:0) C37H74NO8P XZKUOSQHYOWFDI-PGUFJCEWSA-N -BMDB62799 691.515205345 PC(9:0/20:0) C37H74NO8P XQHFCKHXMOVTPR-PGUFJCEWSA-N -BMDB62800 705.530855409 PC(9:0/21:0) C38H76NO8P DUIXEMAPYZKKBI-PSXMRANNSA-N -BMDB62801 719.546505474 PC(9:0/22:0) C39H78NO8P RGNMOUGZXRAJNF-DIPNUNPCSA-N -BMDB62802 733.562155538 PC(9:0/23:0) C40H80NO8P HVWSSWJXFOIYDD-KXQOOQHDSA-N -BMDB62803 717.567240431 PC(O-14:0/18:1(9Z)) C40H80NO7P KKCGBTJTPQETOY-KUNNKMQBSA-N -BMDB62804 715.551590367 PC(O-14:0/18:2(9Z,12Z)) C40H78NO7P IWGRIIUADPXTSC-UESLNCBNSA-N -BMDB62805 775.64549124 PC(O-14:0/22:0) C44H90NO7P KRRFXAFWBWXGHS-VZUYHUTRSA-N -BMDB62807 691.551590854 PC(O-16:0/14:0) C38H78NO7P WYKBXGAXGHENAM-DIPNUNPCSA-N -BMDB62808 745.598540559 PC(O-16:0/18:1(9Z)) C42H84NO7P SIEDNCDNGMIKST-IYEJTHTFSA-N -BMDB62809 741.567240918 PC(O-16:0/18:3(6Z,9Z,12Z)) C42H80NO7P QEWRXEALGMKRGP-MZWPLUPDSA-N -BMDB62810 741.567240431 PC(O-16:0/18:3(9Z,12Z,15Z)) C42H80NO7P AZHDIOOLUSYGPE-CAPSFDDTSA-N -BMDB62811 773.629841176 PC(O-16:0/20:1(11Z)) C44H88NO7P RZVLQGOIANISBO-GRVDSVFJSA-N -BMDB62812 771.614190623 PC(O-16:0/20:2(11Z,14Z)) C44H86NO7P ZYLPVUZBZNMVMR-ZBBHDILGSA-N -BMDB62813 769.598541047 PC(O-16:0/20:3(8Z,11Z,14Z)) C44H84NO7P VYKSGWCIVDQIQR-MEAIPJDCSA-N -BMDB62814 767.582890982 PC(O-16:0/20:4(5Z,8Z,11Z,14Z)) C44H82NO7P DUUSFCFZBREELS-WWBBCYQPSA-N -BMDB62815 765.567240918 PC(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C44H80NO7P YHSSHPWVFALMBA-IARQOZKNSA-N -BMDB62817 793.598541047 PC(O-16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C46H84NO7P VGMPOLIXNOOTMT-HEYUSFSCSA-N -BMDB62819 747.614191111 PC(O-17:0/17:0) C42H86NO7P SLZUFSMGYDSDNB-VQJSHJPSSA-N -BMDB62820 691.551590854 PC(O-18:0/12:0) C38H78NO7P SCBCAJMFNKQLFX-DIPNUNPCSA-N -BMDB62821 717.567240918 PC(O-18:0/14:1(9Z)) C40H80NO7P JAYJLDJDIZHIGU-DTKYWWSASA-N -BMDB62822 747.614190623 PC(O-18:0/16:0) C42H86NO7P GTFLTTXDLGEBAI-VQJSHJPSSA-N -BMDB62823 745.598540559 PC(O-18:0/16:1(9Z)) C42H84NO7P WFFMOIADEZZLFU-HVLKLTLRSA-N -BMDB62824 773.629840687 PC(O-18:0/18:1(9Z)) C44H88NO7P JDBBQTCNJFZWPL-KXTYCBLYSA-N -BMDB62825 769.598541047 PC(O-18:0/18:3(6Z,9Z,12Z)) C44H84NO7P MDZVCBQVXWZBOL-QEGPCSBISA-N -BMDB62826 769.598540559 PC(O-18:0/18:3(9Z,12Z,15Z)) C44H84NO7P GKKOTWSKEIRXDA-JUUDQZDJSA-N -BMDB62827 767.582890982 PC(O-18:0/18:4(6Z,9Z,12Z,15Z)) C44H82NO7P IQGMAFMVIYAJCQ-WHZQUDHQSA-N -BMDB62829 797.629841176 PC(O-18:0/20:3(8Z,11Z,14Z)) C46H88NO7P ITTGOTHIEJWVDA-FMMXMNMWSA-N -BMDB62831 793.598541047 PC(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C46H84NO7P ISUWUEZOULAQMD-WQDQUKPRSA-N -BMDB62832 821.629841176 PC(O-18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C48H88NO7P HJDYJUQFSIJNGA-BGDNETPNSA-N -BMDB62833 793.598540559 PC(O-18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C46H84NO7P VJNPDLZENXBRLB-MQEDXBOASA-N -BMDB62834 747.614190623 PC(O-20:0/14:0) C42H86NO7P WYLXSSKRFXZLGS-VQJSHJPSSA-N -BMDB62835 745.598541047 PC(O-20:0/14:1(9Z)) C42H84NO7P KXGWGPVSNKQXRB-XTSQRIEGSA-N -BMDB62836 775.64549124 PC(O-20:0/16:0) C44H90NO7P LYTUERCDYBANSA-VZUYHUTRSA-N -BMDB62837 773.629840687 PC(O-20:0/16:1(9Z)) C44H88NO7P IMGMENFUBIMZDJ-RPBJOJELSA-N -BMDB62838 803.676791369 PC(O-20:0/18:0) C46H94NO7P FJHUSOLWXAPDEY-WBVITSLISA-N -BMDB62842 821.629841176 PC(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C48H88NO7P AGKCACWGAXVMPI-BVWWTNGZSA-N -BMDB62858 245.162708229 Pivaloylcarnitine C12H23NO4 YICAQFPUDACYGQ-UHFFFAOYSA-N -BMDB62860 748.658090554 TG(12:0/12:0/20:1(11Z))[iso3] C47H88O6 GRNYLLDULGFJIH-DMKFJGBSSA-N -BMDB62861 746.642440489 TG(12:0/12:0/20:2(11Z,14Z))[iso3] C47H86O6 CVVRPLLCUNBBAA-VOXCOYEFSA-N -BMDB62862 742.61114036 TG(12:0/12:0/20:4(5Z,8Z,11Z,14Z))[iso3] C47H82O6 LYHWFHTYVJGJCI-ZSUQOKDXSA-N -BMDB62863 748.658090554 TG(12:0/14:0/18:1(9Z))[iso6] C47H88O6 MVBJOSAJFXMGHL-MWEXPPKQSA-N -BMDB62864 746.642440489 TG(12:0/14:0/18:2(9Z,12Z))[iso6] C47H86O6 LXHJRBQAAZJFFA-BAGKPWEUSA-N -BMDB62865 742.61114036 TG(12:0/14:0/18:4(6Z,9Z,12Z,15Z))[iso6] C47H82O6 DQTSGDMJXFCFHQ-PNFPWBPJSA-N -BMDB62866 774.673740618 TG(12:0/14:0/20:2(11Z,14Z))[iso6] C49H90O6 CYWGAXSMAHWMGU-VELRQWCZSA-N -BMDB62867 748.658090554 TG(12:0/14:1(9Z)/18:0)[iso6] C47H88O6 AVOSYSUBIBSHKI-HZMXKNRLSA-N -BMDB62868 746.642440489 TG(12:0/14:1(9Z)/18:1(9Z))[iso6] C47H86O6 MBDIKHHUXKJHDN-QUZDWSSOSA-N -BMDB62869 742.61114036 TG(12:0/14:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C47H82O6 IKBGEQZYRUHAHP-HPWCZUARSA-N -BMDB62870 742.61114036 TG(12:0/14:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C47H82O6 AFFSAIPAHKQBQB-BLWWZHSPSA-N -BMDB62871 774.673740618 TG(12:0/14:1(9Z)/20:1(11Z))[iso6] C49H90O6 WEVPBZFUEDNYCR-SWVYRDHKSA-N -BMDB62872 748.658090548 TG(12:0/16:0/16:1(9Z))[iso6] C47H88O6 OUKDNADVOQVFAR-NBTXLFQMSA-N -BMDB62873 774.673740618 TG(12:0/16:0/18:2(9Z,12Z))[iso6] C49H90O6 JORMHQSOEAESEA-XKGSDZNMSA-N -BMDB62874 802.705040747 TG(12:0/16:0/20:2(11Z,14Z))[iso6] C51H94O6 JPEYPDKNKAECDK-KRXHXFEDSA-N -BMDB62875 800.689390682 TG(12:0/16:0/20:3(8Z,11Z,14Z))[iso6] C51H92O6 LSXSLOKSIWRONY-NAQQPVJDSA-N -BMDB62876 826.705040747 TG(12:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6] C53H94O6 MXNVSGZRQAPTRK-PTHBIUEKSA-N -BMDB62877 746.642440484 TG(12:0/16:1(9Z)/16:1(9Z))[iso3] C47H86O6 LJXSUVSRRMQRRA-WHTYERKGSA-N -BMDB62878 774.673740612 TG(12:0/16:1(9Z)/18:1(9Z))[iso6] C49H90O6 MIEULIUWCBAVBF-XXVKYOKDSA-N -BMDB62879 802.705040747 TG(12:0/16:1(9Z)/20:1(11Z))[iso6] C51H94O6 YUFODVPWPWJIPV-DLDHQVKUSA-N -BMDB62880 800.689390682 TG(12:0/16:1(9Z)/20:2(11Z,14Z))[iso6] C51H92O6 CBQKNYIQOAJYOW-CUFXHORCSA-N -BMDB62881 818.736340876 TG(12:0/16:1(9Z)/21:0)[iso6] C52H98O6 NSVUZTVADNFZSD-QHFPHGORSA-N -BMDB62882 832.751990932 TG(12:0/16:1(9Z)/22:0)[iso6] C53H100O6 BUWKZKZKQQRMFN-QNQJCTKXSA-N -BMDB62883 818.736340876 TG(12:0/17:0/20:1(11Z))[iso6] C52H98O6 SCITWUZDHVUOGE-GXPDXSPXSA-N -BMDB62884 816.720690811 TG(12:0/17:0/20:2(11Z,14Z))[iso6] C52H96O6 RPZKNMRSPIPUJS-SYALKDFFSA-N -BMDB62885 840.720690811 TG(12:0/17:0/22:4(7Z,10Z,13Z,16Z))[iso6] C54H96O6 FXUNFLVNPAPRED-NQMIOBIPSA-N -BMDB62886 838.705040747 "TG(12:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z)) [iso6]" C54H94O6 CREXGVDCPQBJHO-PKJNFJNPSA-N -BMDB62887 802.705040747 TG(12:0/18:0/18:2(9Z,12Z))[iso6] C51H94O6 WSEFKAMFRMFZNK-SPCJHRPBSA-N -BMDB62888 800.689390682 TG(12:0/18:0/18:3(6Z,9Z,12Z))[iso6] C51H92O6 ROQIOXAIYDBLMI-XARIDSIQSA-N -BMDB62889 800.689390682 TG(12:0/18:0/18:3(9Z,12Z,15Z))[iso6] C51H92O6 BEHCIKXBZPPALT-GQVMGWSFSA-N -BMDB62890 832.75199094 TG(12:0/18:0/20:1(11Z))[iso6] C53H100O6 QHVHJGFVANFNIG-CMPWZDCQSA-N -BMDB62891 830.736340876 TG(12:0/18:0/20:2(11Z,14Z))[iso6] C53H98O6 VAVYYRAXCZMJLD-KMNFNRKXSA-N -BMDB62892 828.720690811 TG(12:0/18:0/20:3(8Z,11Z,14Z))[iso6] C53H96O6 XGLSJRPIBRAFDY-LPYJYWNVSA-N -BMDB62893 826.705040747 TG(12:0/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C53H94O6 XPMVBSKNIWWAQA-XXNCSQTHSA-N -BMDB62894 854.736340876 TG(12:0/18:0/22:4(7Z,10Z,13Z,16Z))[iso6] C55H98O6 NVMOFUULIGVOLA-QNEBYKNYSA-N -BMDB62895 852.720690811 TG(12:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C55H96O6 ZZEBATNCADRNOB-BNRFIZLMSA-N -BMDB62896 802.705040747 TG(12:0/18:1(9Z)/18:1(9Z))[iso3] C51H94O6 SJWUGKDDADDDHD-BIUCBCRNSA-N -BMDB62897 800.689390682 TG(12:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C51H92O6 PURPKTYKZMLEGI-QEKZCQACSA-N -BMDB62898 818.736340876 TG(12:0/18:1(9Z)/19:0)[iso6] C52H98O6 XQZVDLLWOJQTSL-XXPSLULPSA-N -BMDB62899 832.75199094 TG(12:0/18:1(9Z)/20:0)[iso6] C53H100O6 MQIVOLLFTNWBMM-OFDKUCQMSA-N -BMDB62900 830.736340876 TG(12:0/18:1(9Z)/20:1(11Z))[iso6] C53H98O6 ZCLLAQIDPCDZRM-HNGXOCJTSA-N -BMDB62901 828.720690811 TG(12:0/18:1(9Z)/20:2(11Z,14Z))[iso6] C53H96O6 OPHWHXJWWWOVLK-ACSMYIIGSA-N -BMDB62902 826.705040747 TG(12:0/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C53H94O6 VUBLNAWUBCVBJY-ACUVDGSDSA-N -BMDB62903 846.767641004 TG(12:0/18:1(9Z)/21:0)[iso6] C54H102O6 CKFJANRMGDOEHT-PPMFZCQMSA-N -BMDB62904 852.720690811 TG(12:0/18:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C55H96O6 FZYJOKBEHYPLBA-BOHSMEDASA-N -BMDB62905 816.720690811 TG(12:0/18:2(9Z,12Z)/19:0)[iso6] C52H96O6 NZCVNPXNRZNFIR-WVPRYWMKSA-N -BMDB62906 830.736340876 TG(12:0/18:2(9Z,12Z)/20:0)[iso6] C53H98O6 IRKYEXPJVDQYNO-IJYOWDINSA-N -BMDB62907 828.720690811 TG(12:0/18:2(9Z,12Z)/20:1(11Z))[iso6] C53H96O6 VNOFKXSESRNPPT-ZABPPORYSA-N -BMDB62908 826.705040747 TG(12:0/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C53H94O6 JAEXCRFFNQOZAF-CMNUMAMVSA-N -BMDB62909 844.75199094 TG(12:0/18:2(9Z,12Z)/21:0)[iso6] C54H100O6 ZNCSECOGHWMXLF-BSBIHGEKSA-N -BMDB62910 858.767641004 TG(12:0/18:2(9Z,12Z)/22:0)[iso6] C55H102O6 PDAHUZARCINDIF-RJIJAMFVSA-N -BMDB62911 828.720690811 TG(12:0/18:3(6Z,9Z,12Z)/20:0)[iso6] C53H96O6 KUABSKFJNSJJCC-WAROSUMPSA-N -BMDB62912 826.705040747 TG(12:0/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C53H94O6 GGUBZFSQITUOPH-QCNDHAFKSA-N -BMDB62913 842.736340876 TG(12:0/18:3(6Z,9Z,12Z)/21:0)[iso6] C54H98O6 ONSMCHKWMPFEEO-ZFGOWBRTSA-N -BMDB62914 856.75199094 TG(12:0/18:3(6Z,9Z,12Z)/22:0)[iso6] C55H100O6 PECCGPPZHUNPLO-OIYVKBHPSA-N -BMDB62915 828.720690811 TG(12:0/18:3(9Z,12Z,15Z)/20:0)[iso6] C53H96O6 CIKPTEOQBNTCBH-ZWZRIBDXSA-N -BMDB62916 826.705040747 TG(12:0/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C53H94O6 NSCKVCVXVJTRRP-WJKXVKGOSA-N -BMDB62917 842.736340876 TG(12:0/18:3(9Z,12Z,15Z)/21:0)[iso6] C54H98O6 YARNUHXFWBMPGT-DTAVFOMFSA-N -BMDB62918 856.75199094 TG(12:0/18:3(9Z,12Z,15Z)/22:0)[iso6] C55H100O6 HKVSAJZAPYFKLS-ULPOXIIISA-N -BMDB62919 826.705040747 TG(12:0/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C53H94O6 SFAXDXHZHCYSMY-UCZIVUORSA-N -BMDB62920 840.720690811 TG(12:0/18:4(6Z,9Z,12Z,15Z)/21:0)[iso6] C54H96O6 MSYSVIDEPYGIPJ-QODDASNGSA-N -BMDB62921 854.736340876 TG(12:0/18:4(6Z,9Z,12Z,15Z)/22:0)[iso6] C55H98O6 RZXVPZVEHCHXOZ-UIKBNQDNSA-N -BMDB62922 846.767641004 TG(12:0/19:0/20:1(11Z))[iso6] C54H102O6 ZJAMPDZFZUXTNF-CPVPHCQOSA-N -BMDB62923 844.75199094 TG(12:0/19:0/20:2(11Z,14Z))[iso6] C54H100O6 DDWWNLPQVFVVHK-AZJVGZRGSA-N -BMDB62924 842.736340876 TG(12:0/19:0/20:3(8Z,11Z,14Z))[iso6] C54H98O6 VYFUIGAABXGCHN-KNQBBJAXSA-N -BMDB62925 840.720690811 TG(12:0/19:0/20:4(5Z,8Z,11Z,14Z))[iso6] C54H96O6 PRJVEYMTIMLMKT-IOWPNFBQSA-N -BMDB62926 838.705040747 "TG(12:0/19:0/20:5(5Z,8Z,11Z,14Z,17Z)) [iso6]" C54H94O6 IBMHCOHGVKCHST-PDYQZEQOSA-N -BMDB62927 868.75199094 TG(12:0/19:0/22:4(7Z,10Z,13Z,16Z))[iso6] C56H100O6 HSPFBEZCZCSGHP-OHYWWWSCSA-N -BMDB62928 866.736340876 TG(12:0/19:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H98O6 UZESERBCFQEOJN-ZHRHQZFOSA-N -BMDB62929 864.720690811 TG(12:0/19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 ZJMCMRBZPWIKOR-SROFBIQXSA-N -BMDB62930 858.767641004 TG(12:0/20:0/20:2(11Z,14Z))[iso6] C55H102O6 SVXLLGLOBZCVOX-DFVOHZRTSA-N -BMDB62931 856.75199094 TG(12:0/20:0/20:3(8Z,11Z,14Z))[iso6] C55H100O6 WVVSIJRZVJIVCG-QJWPNMPZSA-N -BMDB62932 854.736340876 TG(12:0/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H98O6 JZPVBZYHZFOOSG-LRVQMSRGSA-N -BMDB62933 852.720690811 TG(12:0/20:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C55H96O6 QXIJWHIKLQHJPN-RBOLYARQSA-N -BMDB62934 882.767641004 TG(12:0/20:0/22:4(7Z,10Z,13Z,16Z))[iso6] C57H102O6 RKORFIGATZMSDF-AOVPCCCBSA-N -BMDB62935 880.75199094 TG(12:0/20:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H100O6 XFSYXEGJYOCSNZ-GWANBXFOSA-N -BMDB62936 878.736340876 TG(12:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 XFUIHQAOPZPIMB-DWMOCKPMSA-N -BMDB62937 858.767641004 TG(12:0/20:1(11Z)/20:1(11Z))[iso3] C55H102O6 ITKPTVCPGKAUSR-IWSWCIDJSA-N -BMDB62938 856.75199094 TG(12:0/20:1(11Z)/20:2(11Z,14Z))[iso6] C55H100O6 GQRHFSUEYMNFGP-LXXYRXIYSA-N -BMDB62939 854.736340876 TG(12:0/20:1(11Z)/20:3(8Z,11Z,14Z))[iso6] C55H98O6 SOLVSVVHDNLWGB-GNNBUCJLSA-N -BMDB62940 852.720690811 TG(12:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C55H96O6 SFNMQJOWSONERD-IWHWYHGVSA-N -BMDB62941 880.75199094 TG(12:0/20:1(11Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H100O6 IZOVEEZIPGFTHR-UXIHGXOZSA-N -BMDB62942 878.736340876 TG(12:0/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 ISSDVCAZGDNZNW-HRAXXNFGSA-N -BMDB62943 854.736340876 TG(12:0/20:2(11Z,14Z)/20:2(11Z,14Z))[iso3] C55H98O6 APQSFWXWFHPYLD-FKEXGYHUSA-N -BMDB62944 852.720690811 TG(12:0/20:2(11Z,14Z)/20:3(8Z,11Z,14Z))[iso6] C55H96O6 CZWWDPZCCBALQM-MYAVJQEESA-N -BMDB62945 886.798941133 TG(12:0/20:2(11Z,14Z)/22:0)[iso6] C57H106O6 ZYUCRKVOUJUNFA-HOEKCBGGSA-N -BMDB62946 878.736340876 TG(12:0/20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H98O6 YPRWJPINHXHUPY-VWYADHDBSA-N -BMDB62947 870.767641004 TG(12:0/20:3(8Z,11Z,14Z)/21:0)[iso6] C56H102O6 QKRBLQDGBRLIGM-FZFUUPADSA-N -BMDB62948 884.783291069 TG(12:0/20:3(8Z,11Z,14Z)/22:0)[iso6] C57H104O6 VLHYRMSJLUACJA-ULWAXZTGSA-N -BMDB62949 868.75199094 TG(12:0/20:4(5Z,8Z,11Z,14Z)/21:0)[iso6] C56H100O6 MVCFRDRRHPCLEV-HRAXAERFSA-N -BMDB62950 882.767641004 TG(12:0/20:4(5Z,8Z,11Z,14Z)/22:0)[iso6] C57H102O6 MGQMGGUWTIFWOC-VPBVQAAPSA-N -BMDB62951 866.736340876 TG(12:0/20:5(5Z,8Z,11Z,14Z,17Z)/21:0)[iso6] C56H98O6 OZFGEFDUPOAJMN-TUDOIWDXSA-N -BMDB62952 880.75199094 TG(12:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:0)[iso6] C57H100O6 CVUCKDOPJGVEGC-FNCINDQMSA-N -BMDB62953 892.75199094 TG(12:0/21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 JHHGYOALRGWULX-BFHMNYGESA-N -BMDB62954 906.767641004 TG(12:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 DBVWYMAAALQYDW-XKAYJYMOSA-N -BMDB62955 748.658090554 TG(13:0/13:0/18:1(9Z))[iso3] C47H88O6 GGVPEFFSCWJNIA-XKAIORBZSA-N -BMDB62956 746.642440489 TG(13:0/13:0/18:2(9Z,12Z))[iso3] C47H86O6 WCSHVUBSHKREDG-PLMXUYPHSA-N -BMDB62957 742.61114036 TG(13:0/13:0/18:4(6Z,9Z,12Z,15Z))[iso3] C47H82O6 ZDGQXLQHDMBLIA-DNWRMTKGSA-N -BMDB62958 774.673740618 TG(13:0/13:0/20:2(11Z,14Z))[iso3] C49H90O6 CHIHFBRVSHTOGA-XKGSDZNMSA-N -BMDB62959 748.658090554 TG(13:0/14:1(9Z)/17:0)[iso6] C47H88O6 NYTHUGZAKYLXQB-HZMXKNRLSA-N -BMDB62960 818.736340876 TG(13:0/14:1(9Z)/22:0)[iso6] C52H98O6 HMIFSEWNIWVFIH-XYCSPTTKSA-N -BMDB62961 748.658090554 TG(13:0/15:0/16:1(9Z))[iso6] C47H88O6 NWMBZDQXLSCPKA-WVSHCNQOSA-N -BMDB62962 774.673740618 TG(13:0/15:0/18:2(9Z,12Z))[iso6] C49H90O6 IUDOKIABRZVDOI-XAOJWIKWSA-N -BMDB62963 802.705040747 TG(13:0/15:0/20:2(11Z,14Z))[iso6] C51H94O6 RASDPAORLPVSRI-CAMLYDKOSA-N -BMDB62964 800.689390682 TG(13:0/15:0/20:3(8Z,11Z,14Z))[iso6] C51H92O6 XTIXMOHKZTYZBK-OIKKTVPGSA-N -BMDB62965 826.705040747 TG(13:0/15:0/22:4(7Z,10Z,13Z,16Z))[iso6] C53H94O6 RJZNVPSSFBYEQG-BIPRTJSSSA-N -BMDB62966 818.736340876 TG(13:0/16:0/20:1(11Z))[iso6] C52H98O6 XVLAWFCHGNBVMP-ZAHSUTTFSA-N -BMDB62967 816.720690811 TG(13:0/16:0/20:2(11Z,14Z))[iso6] C52H96O6 OKUVFELQPOGWIP-UZCVOGOFSA-N -BMDB62968 840.720690811 TG(13:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6] C54H96O6 VYBIOIYDPQZXCL-FXFXKYDVSA-N -BMDB62969 838.705040747 "TG(13:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) [iso6]" C54H94O6 PSZFRKPKXBAWCL-PGPPVNBKSA-N -BMDB62970 818.736340876 TG(13:0/16:1(9Z)/20:0)[iso6] C52H98O6 RKHRZOFBRXROOF-KMTXBVSESA-N -BMDB62971 816.720690811 TG(13:0/16:1(9Z)/20:1(11Z))[iso6] C52H96O6 HXLJROVZNRBAEI-GHVXXPGQSA-N -BMDB62972 832.75199094 TG(13:0/16:1(9Z)/21:0)[iso6] C53H100O6 YBSVRQOYFXBGQD-DKKVYINCSA-N -BMDB62973 846.767641004 TG(13:0/16:1(9Z)/22:0)[iso6] C54H102O6 SVNKNRVTRHEZLT-FECCDXIYSA-N -BMDB62974 838.705040747 "TG(13:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) [iso6]" C54H94O6 FNTLKBBHGHNWDC-GXUXFMQRSA-N -BMDB62975 802.705040747 TG(13:0/17:0/18:2(9Z,12Z))[iso6] C51H94O6 OZJYKACPBBLZSG-ZRCXKCERSA-N -BMDB62976 800.689390682 TG(13:0/17:0/18:3(6Z,9Z,12Z))[iso6] C51H92O6 JQSYLJUKYGRJSK-NLXZCDGQSA-N -BMDB62977 800.689390682 TG(13:0/17:0/18:3(9Z,12Z,15Z))[iso6] C51H92O6 KAEPXNLYZDRZMB-JCEPAQEVSA-N -BMDB62978 832.75199094 TG(13:0/17:0/20:1(11Z))[iso6] C53H100O6 CVOIZWDZHGKEOI-IHQTTYFESA-N -BMDB62979 830.736340876 TG(13:0/17:0/20:2(11Z,14Z))[iso6] C53H98O6 QPFDNHJFFVQVBS-GLRQSATNSA-N -BMDB62980 828.720690811 TG(13:0/17:0/20:3(8Z,11Z,14Z))[iso6] C53H96O6 ZKJGYVGAJPHYFC-JNLCAOHFSA-N -BMDB62981 826.705040747 TG(13:0/17:0/20:4(5Z,8Z,11Z,14Z))[iso6] C53H94O6 LRPVSDFSGZQPBM-NTMDFEFCSA-N -BMDB62982 854.736340876 TG(13:0/17:0/22:4(7Z,10Z,13Z,16Z))[iso6] C55H98O6 QVKNIVNDYMBGDU-FNFGEXBTSA-N -BMDB62983 852.720690811 TG(13:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C55H96O6 AHUWPHLEHINDNR-ZIDJEGDISA-N -BMDB62984 818.736340876 TG(13:0/18:0/18:1(9Z))[iso6] C52H98O6 QJWQMVKTAVFSDI-XXPSLULPSA-N -BMDB62985 816.720690811 TG(13:0/18:0/18:2(9Z,12Z))[iso6] C52H96O6 MPSZKUJKQLQTGL-LPISRMCOSA-N -BMDB62986 846.767641004 TG(13:0/18:0/20:1(11Z))[iso6] C54H102O6 QUWUOGDVBVKMGQ-MOCMJZBUSA-N -BMDB62987 844.75199094 TG(13:0/18:0/20:2(11Z,14Z))[iso6] C54H100O6 PWZURXUZDLYDSO-WBEHMSRMSA-N -BMDB62988 842.736340876 TG(13:0/18:0/20:3(8Z,11Z,14Z))[iso6] C54H98O6 ZFKDRSAWXWIDMM-VGOOZKSFSA-N -BMDB62989 840.720690811 TG(13:0/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C54H96O6 WKJHFGHOTZEQSN-QDDTUDEOSA-N -BMDB62990 838.705040747 "TG(13:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) [iso6]" C54H94O6 UNZGAPDOGSJJPO-MCCURMAYSA-N -BMDB62991 868.75199094 TG(13:0/18:0/22:4(7Z,10Z,13Z,16Z))[iso6] C56H100O6 YGUMWAQSARLQFW-CHHNJTPUSA-N -BMDB62992 866.736340876 TG(13:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H98O6 HFVHAUAVZCIYCK-BOQCSKEFSA-N -BMDB62993 864.720690811 TG(13:0/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 CZHDPIRCZCRMPL-KTQAEESXSA-N -BMDB62994 816.720690811 TG(13:0/18:1(9Z)/18:1(9Z))[iso3] C52H96O6 CKCCBJSARYBDHM-IGSPDIOOSA-N -BMDB62995 832.75199094 TG(13:0/18:1(9Z)/19:0)[iso6] C53H100O6 MRFSPTSAEVUAAE-RXQRVFRESA-N -BMDB62996 846.767641004 TG(13:0/18:1(9Z)/20:0)[iso6] C54H102O6 ACQCATAWVAMHOW-WRHVFJBQSA-N -BMDB62997 844.75199094 TG(13:0/18:1(9Z)/20:1(11Z))[iso6] C54H100O6 HLPHIWKXOMMFJW-VXAZLYRPSA-N -BMDB62998 842.736340876 TG(13:0/18:1(9Z)/20:2(11Z,14Z))[iso6] C54H98O6 LQFDWCOUHOLIAZ-XQFFWOKXSA-N -BMDB62999 840.720690811 TG(13:0/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C54H96O6 FVIWAMDZIUQJFG-ICFVDTCLSA-N -BMDB63000 838.705040747 "TG(13:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) [iso6]" C54H94O6 FNUNSCUMSTXXAA-SNLCNMJCSA-N -BMDB63001 866.736340876 TG(13:0/18:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C56H98O6 SKGYSQPNOVMJNM-ZZDJFGAMSA-N -BMDB63002 864.720690811 TG(13:0/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 RKIMJDOKUVKTAO-OTTILKOXSA-N -BMDB63003 830.736340876 TG(13:0/18:2(9Z,12Z)/19:0)[iso6] C53H98O6 PEAGXULBJKUAIC-SCWHSDSMSA-N -BMDB63004 844.75199094 TG(13:0/18:2(9Z,12Z)/20:0)[iso6] C54H100O6 VLBFRGUWJIXFOW-UVCOXGRGSA-N -BMDB63005 842.736340876 TG(13:0/18:2(9Z,12Z)/20:1(11Z))[iso6] C54H98O6 POBJFNDKDPKMRR-ZUKCBSEISA-N -BMDB63006 840.720690811 TG(13:0/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C54H96O6 YTKDKIKYOWJUBZ-UTYKXLKPSA-N -BMDB63007 838.705040747 "TG(13:0/18:2(9Z,12Z)/20:3(8Z,11Z,14Z)) [iso6]" C54H94O6 RJDDQDDFVRXSER-UGJPQIPGSA-N -BMDB63008 858.767641004 TG(13:0/18:2(9Z,12Z)/21:0)[iso6] C55H102O6 CNPYKTUWCNLZQA-JPCNOYOISA-N -BMDB63009 864.720690811 TG(13:0/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C56H96O6 KBAFIDSGAZQARH-XRIMMKGCSA-N -BMDB63010 828.720690811 TG(13:0/18:3(6Z,9Z,12Z)/19:0)[iso6] C53H96O6 MKJAQODNPUUQJU-SOGCOJPQSA-N -BMDB63011 842.736340876 TG(13:0/18:3(6Z,9Z,12Z)/20:0)[iso6] C54H98O6 QXUCOIAXMVMJPL-UBHNKEJASA-N -BMDB63012 840.720690811 TG(13:0/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C54H96O6 TYSISORFUUEKNA-XWRNPFKMSA-N -BMDB63013 838.705040747 "TG(13:0/18:3(6Z,9Z,12Z)/20:2(11Z,14Z)) [iso6]" C54H94O6 HIZLCDUBCWMXSQ-YSZLBLERSA-N -BMDB63014 856.75199094 TG(13:0/18:3(6Z,9Z,12Z)/21:0)[iso6] C55H100O6 KCSFDVNMTBKNRH-BEOILNTPSA-N -BMDB63015 870.767641004 TG(13:0/18:3(6Z,9Z,12Z)/22:0)[iso6] C56H102O6 ZBMXEESYDQWCQB-HMSZEYHWSA-N -BMDB63016 828.720690811 TG(13:0/18:3(9Z,12Z,15Z)/19:0)[iso6] C53H96O6 XCRVZQKOXHLKQX-YUIQGFHTSA-N -BMDB63017 842.736340876 TG(13:0/18:3(9Z,12Z,15Z)/20:0)[iso6] C54H98O6 WKYHJLWZNBYHAB-AEKSPWCTSA-N -BMDB63018 840.720690811 TG(13:0/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C54H96O6 XGAFWZHWPWRYRV-JCCKQUIFSA-N -BMDB63019 838.705040747 "TG(13:0/18:3(9Z,12Z,15Z)/20:2(11Z,14Z)) [iso6]" C54H94O6 GITROKWKDRHGHQ-TVTDUOMKSA-N -BMDB63020 856.75199094 TG(13:0/18:3(9Z,12Z,15Z)/21:0)[iso6] C55H100O6 FRHOLDLEYVPPSH-VQGSQCRJSA-N -BMDB63021 870.767641004 TG(13:0/18:3(9Z,12Z,15Z)/22:0)[iso6] C56H102O6 WQADSUPBDNWBQM-UDHMGBOHSA-N -BMDB63022 826.705040747 TG(13:0/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C53H94O6 XECCMAXKFAAKSU-LOHFTLRCSA-N -BMDB63023 840.720690811 TG(13:0/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C54H96O6 CYGLTSNZHJSZCI-FPVDUJBWSA-N -BMDB63024 838.705040747 "TG(13:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z)) [iso6]" C54H94O6 QUNPQBBDPLOGIB-UKIVMDHSSA-N -BMDB63025 854.736340876 TG(13:0/18:4(6Z,9Z,12Z,15Z)/21:0)[iso6] C55H98O6 NUKNGHBZJMVIRF-IZJXHMBISA-N -BMDB63026 868.75199094 TG(13:0/18:4(6Z,9Z,12Z,15Z)/22:0)[iso6] C56H100O6 GUYIIRIEUDZMHW-OIRFYMOQSA-N -BMDB63027 858.767641004 TG(13:0/19:0/20:2(11Z,14Z))[iso6] C55H102O6 GGDFLPOOONJXKF-XQHUZZSBSA-N -BMDB63028 856.75199094 TG(13:0/19:0/20:3(8Z,11Z,14Z))[iso6] C55H100O6 SKEHTPDBNRFSFP-BGMXHFECSA-N -BMDB63029 854.736340876 TG(13:0/19:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H98O6 FBZFBASQMCMBJP-GQVSLKNLSA-N -BMDB63030 852.720690811 TG(13:0/19:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C55H96O6 KTDQXVPKYOJWOG-XGBCWUNFSA-N -BMDB63031 882.767641004 TG(13:0/19:0/22:4(7Z,10Z,13Z,16Z))[iso6] C57H102O6 XXRRJDZBDOTZKQ-XRTBBFENSA-N -BMDB63032 880.75199094 TG(13:0/19:0/22:5(7Z,10Z,13Z,16Z,19Z)) C57H100O6 PCIGODHFXXZPQE-ZDXQVSIVSA-N -BMDB63033 878.736340876 TG(13:0/19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 RNYPYOLUVPCWFW-QCPSIIGFSA-N -BMDB63034 870.767641004 TG(13:0/20:0/20:3(8Z,11Z,14Z))[iso6] C56H102O6 VRICKTNJSPGHHB-QPBGLANQSA-N -BMDB63035 868.75199094 TG(13:0/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H100O6 VSGSABBJUHCJEP-UNUKUHHDSA-N -BMDB63036 866.736340876 TG(13:0/20:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H98O6 HXJUQDNTHUHKNC-SBCLTYBFSA-N -BMDB63037 892.75199094 TG(13:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 QGVGATHFHMISPE-MGVKHULLSA-N -BMDB63038 870.767641004 TG(13:0/20:1(11Z)/20:2(11Z,14Z))[iso6] C56H102O6 RLYKBVXUOITRNC-YYFIIFAWSA-N -BMDB63039 868.75199094 TG(13:0/20:1(11Z)/20:3(8Z,11Z,14Z))[iso6] C56H100O6 GVATYCQPFPPDCU-PQBFTWPVSA-N -BMDB63040 866.736340876 TG(13:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C56H98O6 WKMQXAWGDBGPLW-WPECZBSESA-N -BMDB63041 864.720690811 TG(13:0/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H96O6 XYZTXZZQLIABPO-JSIQVRSFSA-N -BMDB63042 892.75199094 TG(13:0/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 RAYBRQHFOJPEHD-SYJZTXSGSA-N -BMDB63043 890.736340876 TG(13:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 SNWAOGURWHHSCC-YCJWTOGFSA-N -BMDB63044 868.75199094 TG(13:0/20:2(11Z,14Z)/20:2(11Z,14Z))[iso3] C56H100O6 WBAIDSIARPKCRG-WEVISBAQSA-N -BMDB63045 866.736340876 TG(13:0/20:2(11Z,14Z)/20:3(8Z,11Z,14Z))[iso6] C56H98O6 WAUCVVAHGQIVSW-UYDYAKRYSA-N -BMDB63046 864.720690811 TG(13:0/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C56H96O6 XCXAOKOIHAJPDA-ZGASUQONSA-N -BMDB63047 886.798941133 TG(13:0/20:2(11Z,14Z)/21:0)[iso6] C57H106O6 DVXHSMSOPLCBJA-JGWBZRBGSA-N -BMDB63048 892.75199094 TG(13:0/20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H100O6 HLYUUJHRBVGOGI-BATKRMTGSA-N -BMDB63049 890.736340876 TG(13:0/20:2(11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 DOKKYCNIKZOORW-IPMKVYKCSA-N -BMDB63050 888.720690811 TG(13:0/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H96O6 IJSODANHJUMVFP-MGHIJNBKSA-N -BMDB63051 884.783291069 TG(13:0/20:3(8Z,11Z,14Z)/21:0)[iso6] C57H104O6 MEKRZPGBUSDGMQ-LXYUNERFSA-N -BMDB63052 890.736340876 TG(13:0/20:3(8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H98O6 JXFHTHDRVIFTMW-XVOSIWKKSA-N -BMDB63053 888.720690811 TG(13:0/20:3(8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H96O6 MYCVZNAVFHAUCQ-KIDMWXMLSA-N -BMDB63054 886.705040747 TG(13:0/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H94O6 MQJSRJLYYUXOOK-XSUKWBRQSA-N -BMDB63055 882.767641004 TG(13:0/20:4(5Z,8Z,11Z,14Z)/21:0)[iso6] C57H102O6 KXKPOODGHPGHKT-YPIPWELVSA-N -BMDB63056 888.720690811 TG(13:0/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H96O6 CIMIOMZMAPARFJ-FLHSXYFGSA-N -BMDB63057 886.705040747 TG(13:0/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H94O6 XXTMTWCTXAVQLO-HDQUPALVSA-N -BMDB63058 880.75199094 TG(13:0/20:5(5Z,8Z,11Z,14Z,17Z)/21:0)[iso6] C57H100O6 OPHPJZGIMUCXFX-YQIUTSFUSA-N -BMDB63059 886.705040747 TG(13:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H94O6 LMGZUEVEWZNGID-SXQAAMSVSA-N -BMDB63060 906.767641004 TG(13:0/21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 IDXHCFMUKBIJQY-IOHBTVPBSA-N -BMDB63061 748.658090554 TG(14:0/14:0/16:1(9Z))[iso3] C47H88O6 UZLGGKDLJGDGEY-WVSHCNQOSA-N -BMDB63062 774.673740618 TG(14:0/14:0/18:2(9Z,12Z))[iso3] C49H90O6 PQNMFXNJDJFSAL-XKGSDZNMSA-N -BMDB63063 802.705040747 TG(14:0/14:0/20:2(11Z,14Z))[iso3] C51H94O6 ZBGYWUISVSKLJL-KRXHXFEDSA-N -BMDB63064 800.689390682 TG(14:0/14:0/20:3(8Z,11Z,14Z))[iso3] C51H92O6 PEEVPWLSIPWIPE-VGWLKTBOSA-N -BMDB63065 826.705040747 TG(14:0/14:0/22:4(7Z,10Z,13Z,16Z))[iso3] C53H94O6 HPAQAIDULVVZHU-FQZUNKIWSA-N -BMDB63066 748.658090554 TG(14:0/14:1(9Z)/16:0)[iso6] C47H88O6 JRZPEKVQFIJQHH-YVCFFHMXSA-N -BMDB63067 746.642440489 TG(14:0/14:1(9Z)/16:1(9Z))[iso6] C47H86O6 SGPSMGCUZQMTGS-STQHKGLXSA-N -BMDB63068 774.673740618 TG(14:0/14:1(9Z)/18:1(9Z))[iso6] C49H90O6 UVAHIOIFDNNSJD-KEVWEZDZSA-N -BMDB63069 802.705040747 TG(14:0/14:1(9Z)/20:1(11Z))[iso6] C51H94O6 CONMOUURRLRVRA-CAIRIIBHSA-N -BMDB63070 800.689390682 TG(14:0/14:1(9Z)/20:2(11Z,14Z))[iso6] C51H92O6 WSNMQTIYKBFKOK-RJYCVYMFSA-N -BMDB63071 818.736340876 TG(14:0/14:1(9Z)/21:0)[iso6] C52H98O6 IKQVPNFZYICSKE-FBUBQAPCSA-N -BMDB63072 832.75199094 TG(14:0/14:1(9Z)/22:0)[iso6] C53H100O6 CEYRSRJJGFUDSX-GBDWEMPCSA-N -BMDB63073 818.736340876 TG(14:0/15:0/20:1(11Z))[iso6] C52H98O6 KGFYMRDBADNRFA-ZAHSUTTFSA-N -BMDB63074 816.720690811 TG(14:0/15:0/20:2(11Z,14Z))[iso6] C52H96O6 BNMAVVCRFTYTND-UZCVOGOFSA-N -BMDB63075 840.720690811 TG(14:0/15:0/22:4(7Z,10Z,13Z,16Z))[iso6] C54H96O6 RMSVDGYULQBZFR-NFGOXDIMSA-N -BMDB63076 838.705040747 "TG(14:0/15:0/22:5(7Z,10Z,13Z,16Z,19Z)) [iso6]" C54H94O6 OTBZLUUCZPBSNU-KGKPFOGQSA-N -BMDB63077 802.705040747 TG(14:0/16:0/18:2(9Z,12Z))[iso6] C51H94O6 YUIIXXZIUIOJQY-CAMLYDKOSA-N -BMDB63078 800.689390682 TG(14:0/16:0/18:3(6Z,9Z,12Z))[iso6] C51H92O6 ROOGPSPBLOJPPQ-PWWZPJGCSA-N -BMDB63079 800.689390682 TG(14:0/16:0/18:3(9Z,12Z,15Z))[iso6] C51H92O6 IJXMVNJNIOUHCI-ORBOMGMLSA-N -BMDB63080 832.75199094 TG(14:0/16:0/20:1(11Z))[iso6] C53H100O6 PHAZXJMIZJNKNN-HHPGWUGWSA-N -BMDB63081 830.736340876 TG(14:0/16:0/20:2(11Z,14Z))[iso6] C53H98O6 JBDIRAWBRFQEGE-SDCZMQJWSA-N -BMDB63082 828.720690811 TG(14:0/16:0/20:3(8Z,11Z,14Z))[iso6] C53H96O6 FENAYUACXGWLFP-NEDGZQTDSA-N -BMDB63083 826.705040747 TG(14:0/16:0/20:4(5Z,8Z,11Z,14Z))[iso6] C53H94O6 FKJNKIIHHYXTFQ-YJKKQOLLSA-N -BMDB63084 854.736340876 TG(14:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6] C55H98O6 SNUZLEOJKMJJKW-BCFIJSIFSA-N -BMDB63085 852.720690811 TG(14:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C55H96O6 PDOWBMFLISSQRT-NBQUYGMKSA-N -BMDB63086 774.673740612 TG(14:0/16:1(9Z)/16:1(9Z))[iso3] C49H90O6 XUEMVUXNOCIHLG-MOFPORNTSA-N -BMDB63087 802.70504074 TG(14:0/16:1(9Z)/18:1(9Z))[iso6] C51H94O6 QABWZGMVIDDGGI-OVSPJMMSSA-N -BMDB63088 800.689390682 TG(14:0/16:1(9Z)/18:2(9Z,12Z))[iso6] C51H92O6 IWSNEFQVYNGXGZ-ZVCBQIARSA-N -BMDB63089 818.736340876 TG(14:0/16:1(9Z)/19:0)[iso6] C52H98O6 WHNAHGSPJXSFHV-KMTXBVSESA-N -BMDB63090 832.75199094 TG(14:0/16:1(9Z)/20:0)[iso6] C53H100O6 ALZSQWYLHHUOEG-DKKVYINCSA-N -BMDB63091 830.736340876 TG(14:0/16:1(9Z)/20:1(11Z))[iso6] C53H98O6 FKZROTPCYKGHJU-MZQJXXGHSA-N -BMDB63092 828.720690811 TG(14:0/16:1(9Z)/20:2(11Z,14Z))[iso6] C53H96O6 QCEMLZQSNJUFFH-FCVOIVFISA-N -BMDB63093 826.705040747 TG(14:0/16:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C53H94O6 VZAVZRSRDZQJRY-WLVAXTOGSA-N -BMDB63094 846.767641004 TG(14:0/16:1(9Z)/21:0)[iso6] C54H102O6 WJPVDXLBCPFXSS-FECCDXIYSA-N -BMDB63095 852.720690811 TG(14:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C55H96O6 XOVZBEYRPDKHAL-GKRGVYQPSA-N -BMDB63096 818.736340876 TG(14:0/17:0/18:1(9Z))[iso6] C52H98O6 KJAOFVHLADOELN-XXPSLULPSA-N -BMDB63097 816.720690811 TG(14:0/17:0/18:2(9Z,12Z))[iso6] C52H96O6 PTMMGTLFYOOVNO-LPISRMCOSA-N -BMDB63098 846.767641004 TG(14:0/17:0/20:1(11Z))[iso6] C54H102O6 CXSSLLNQUCRVGG-MOCMJZBUSA-N -BMDB63099 844.75199094 TG(14:0/17:0/20:2(11Z,14Z))[iso6] C54H100O6 LBNIAXTWTCVEDE-WBEHMSRMSA-N -BMDB63100 842.736340876 TG(14:0/17:0/20:3(8Z,11Z,14Z))[iso6] C54H98O6 WMHOTLLMUILWBX-IZXHHLLQSA-N -BMDB63101 840.720690811 TG(14:0/17:0/20:4(5Z,8Z,11Z,14Z))[iso6] C54H96O6 ZCUUWDYUENHCLL-SBFBTBDOSA-N -BMDB63102 838.705040747 "TG(14:0/17:0/20:5(5Z,8Z,11Z,14Z,17Z)) [iso6]" C54H94O6 DGXUSUPNUXPCCE-YCZYZSMESA-N -BMDB63103 868.75199094 TG(14:0/17:0/22:4(7Z,10Z,13Z,16Z))[iso6] C56H100O6 VQRMNFIGFUTPML-CHHNJTPUSA-N -BMDB63104 866.736340876 TG(14:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H98O6 PTTOWKDHRZUPQZ-BOQCSKEFSA-N -BMDB63105 864.720690811 TG(14:0/17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 WQMFBEABMBKVCF-KTQAEESXSA-N -BMDB63106 832.751990932 TG(14:0/18:0/18:1(9Z))[iso6] C53H100O6 STJWLLYLXYVNSF-IHQTTYFESA-N -BMDB63107 830.736340876 TG(14:0/18:0/18:2(9Z,12Z))[iso6] C53H98O6 PQNLYGDUOQNSNZ-GLRQSATNSA-N -BMDB63108 828.720690811 TG(14:0/18:0/18:3(6Z,9Z,12Z))[iso6] C53H96O6 WPIXNLNRUFBFSX-DLSBFYMWSA-N -BMDB63109 828.720690811 TG(14:0/18:0/18:3(9Z,12Z,15Z))[iso6] C53H96O6 HYCJEHMBNSROSN-RUNKTZMNSA-N -BMDB63110 826.705040747 TG(14:0/18:0/18:4(6Z,9Z,12Z,15Z))[iso6] C53H94O6 HBXDNORVVBXTEO-KNHXRVBBSA-N -BMDB63111 858.767641004 TG(14:0/18:0/20:2(11Z,14Z))[iso6] C55H102O6 QXBLJSPUDMDKNU-XQHUZZSBSA-N -BMDB63112 856.75199094 TG(14:0/18:0/20:3(8Z,11Z,14Z))[iso6] C55H100O6 ZYFACDKCDVPZSE-XVPMAZIESA-N -BMDB63113 854.736340876 TG(14:0/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H98O6 NOCKWBKJMQWVLP-LWZVRTLFSA-N -BMDB63114 852.720690811 TG(14:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C55H96O6 JYQXYTFYWDKLPT-ZRSFBRENSA-N -BMDB63115 882.767641004 TG(14:0/18:0/22:4(7Z,10Z,13Z,16Z))[iso6] C57H102O6 XEOFILXSSITART-SRWRNLDESA-N -BMDB63116 880.75199094 TG(14:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H100O6 IEIOCZLRHWBWAA-VFYQEISLSA-N -BMDB63117 878.736340876 TG(14:0/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 SRTYEBAWRUTXIT-DYVCWNEUSA-N -BMDB63118 830.736340876 TG(14:0/18:1(9Z)/18:1(9Z))[iso3] C53H98O6 AFLXUGKIZQFJJI-FOQOAFKKSA-N -BMDB63119 828.720690811 TG(14:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C53H96O6 LVCDKQHOIIGWET-NLSPPTNKSA-N -BMDB63120 826.705040747 TG(14:0/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C53H94O6 TYUYVOHLQUKDNN-NSALPRGZSA-N -BMDB63121 826.705040747 TG(14:0/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C53H94O6 GTOYFHSNXPGLKS-HBIZVULXSA-N -BMDB63122 846.767641004 TG(14:0/18:1(9Z)/19:0)[iso6] C54H102O6 KGXWCBPHXXNMHZ-IWRJKWNLSA-N -BMDB63123 858.767641004 TG(14:0/18:1(9Z)/20:1(11Z))[iso6] C55H102O6 PKXAVJXEGNYXLJ-LESPYSKMSA-N -BMDB63124 856.75199094 TG(14:0/18:1(9Z)/20:2(11Z,14Z))[iso6] C55H100O6 HNKDMZBYGADBFP-JODICZGFSA-N -BMDB63125 854.736340876 TG(14:0/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C55H98O6 NUCVTMFYAFILJA-VWMHFWMRSA-N -BMDB63126 852.720690811 TG(14:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C55H96O6 ITNUXAAETYEROX-WSZXHELYSA-N -BMDB63127 880.75199094 TG(14:0/18:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H100O6 XSDZXQPLCUUMHQ-VOLJVZMBSA-N -BMDB63128 878.736340876 TG(14:0/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 HWQNUCDGDUFCMI-RQBJIVHESA-N -BMDB63129 826.705040747 TG(14:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C53H94O6 UVOGHPPAYFAQIT-HWJOWLPRSA-N -BMDB63130 844.75199094 TG(14:0/18:2(9Z,12Z)/19:0)[iso6] C54H100O6 PBFVSBYKDKSDLA-CDRGWSHPSA-N -BMDB63131 858.767641004 TG(14:0/18:2(9Z,12Z)/20:0)[iso6] C55H102O6 TXMWKTABZBAJCW-QLHBUVOUSA-N -BMDB63132 856.75199094 TG(14:0/18:2(9Z,12Z)/20:1(11Z))[iso6] C55H100O6 DQXQIWIQYYEGLG-MMWLGPPDSA-N -BMDB63133 854.736340876 TG(14:0/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C55H98O6 WROLOLWFWWANQZ-OPPBVYHLSA-N -BMDB63134 852.720690811 TG(14:0/18:2(9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C55H96O6 KRVDGBILMBJWGW-DYHAXEKXSA-N -BMDB63135 886.798941133 TG(14:0/18:2(9Z,12Z)/22:0)[iso6] C57H106O6 WUUWGORPQFKFQN-XDVOZUNOSA-N -BMDB63136 878.736340876 TG(14:0/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H98O6 TXTFQSNMOAFCQE-YLQHFSMTSA-N -BMDB63137 842.736340876 TG(14:0/18:3(6Z,9Z,12Z)/19:0)[iso6] C54H98O6 MPIXKWXMBIWCTC-BTTVZRPISA-N -BMDB63138 856.75199094 TG(14:0/18:3(6Z,9Z,12Z)/20:0)[iso6] C55H100O6 XOUODEXYIDULFE-AWBUIGFBSA-N -BMDB63139 854.736340876 TG(14:0/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C55H98O6 JFGKZRHSXFSHMF-UYCWGEELSA-N -BMDB63140 852.720690811 TG(14:0/18:3(6Z,9Z,12Z)/20:2(11Z,14Z))[iso6] C55H96O6 QQZZZCIYMICCKG-FMJDUTPESA-N -BMDB63141 870.767641004 TG(14:0/18:3(6Z,9Z,12Z)/21:0)[iso6] C56H102O6 LCNKSLJADTTXQE-SLKRYXERSA-N -BMDB63142 884.783291069 TG(14:0/18:3(6Z,9Z,12Z)/22:0)[iso6] C57H104O6 IBKTWXVFMTZJMM-OYVCJIMQSA-N -BMDB63143 842.736340876 TG(14:0/18:3(9Z,12Z,15Z)/19:0)[iso6] C54H98O6 QWAIIEGKHVQOLZ-AHWVLIIWSA-N -BMDB63144 856.75199094 TG(14:0/18:3(9Z,12Z,15Z)/20:0)[iso6] C55H100O6 VHWNCJQPNDUBCY-ZNVCVHDVSA-N -BMDB63145 854.736340876 TG(14:0/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C55H98O6 JHMJQPFJXDWUMJ-BVQPMVRCSA-N -BMDB63146 852.720690811 TG(14:0/18:3(9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C55H96O6 WGTADRBQBBKAGF-QXZBKNQSSA-N -BMDB63147 870.767641004 TG(14:0/18:3(9Z,12Z,15Z)/21:0)[iso6] C56H102O6 WJMHAVUQVAENJS-JRHDUCERSA-N -BMDB63148 884.783291069 TG(14:0/18:3(9Z,12Z,15Z)/22:0)[iso6] C57H104O6 PZGMSWKRVOYKSW-SZZNRBPJSA-N -BMDB63149 840.720690811 TG(14:0/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C54H96O6 GGUIMLXFMCYCLU-CUAKEYPRSA-N -BMDB63150 854.736340876 TG(14:0/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C55H98O6 PTAWPTKMXDLFKO-VZXSZJQLSA-N -BMDB63151 852.720690811 TG(14:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z))[iso6] C55H96O6 HCFBZCCMOSAJDD-ZWMBOXBKSA-N -BMDB63152 868.75199094 TG(14:0/18:4(6Z,9Z,12Z,15Z)/21:0)[iso6] C56H100O6 ZJSNMLWXBPTYPP-JLZMKYLLSA-N -BMDB63153 882.767641004 TG(14:0/18:4(6Z,9Z,12Z,15Z)/22:0)[iso6] C57H102O6 ADDMBQHEJRQEPO-KHTHNNQUSA-N -BMDB63154 870.767641004 TG(14:0/19:0/20:3(8Z,11Z,14Z))[iso6] C56H102O6 JOILGOBKLGUCKD-OIABVJSBSA-N -BMDB63155 868.75199094 TG(14:0/19:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H100O6 JMNRUCWECUAVCB-FSZAKRSJSA-N -BMDB63156 866.736340876 TG(14:0/19:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H98O6 KLVDYYKYMPXPCG-WEYNYNRMSA-N -BMDB63157 892.75199094 TG(14:0/19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 YVVGMRLYGMVCQC-ZGPGMLSXSA-N -BMDB63158 886.798941133 TG(14:0/20:0/20:2(11Z,14Z))[iso6] C57H106O6 OZJZLHIZXUGMED-LOBNJYFQSA-N -BMDB63159 884.783291069 TG(14:0/20:0/20:3(8Z,11Z,14Z))[iso6] C57H104O6 SENTUJWTPLLHAV-SBIMNFJZSA-N -BMDB63160 882.767641004 TG(14:0/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H102O6 XJKXBTKTOXZQFL-IDPHYFMRSA-N -BMDB63161 880.75199094 TG(14:0/20:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H100O6 QVTBPCIHCQQWGM-FWMKDLLLSA-N -BMDB63162 906.767641004 TG(14:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 JCZVOJRQXOBKKH-NSADPMFISA-N -BMDB63163 886.798941133 TG(14:0/20:1(11Z)/20:1(11Z))[iso3] C57H106O6 DQXHESFTNHULCI-UKKZZJOHSA-N -BMDB63164 884.783291069 TG(14:0/20:1(11Z)/20:2(11Z,14Z))[iso6] C57H104O6 BLFWZVXARGMXGK-LCVXGRMFSA-N -BMDB63165 882.767641004 TG(14:0/20:1(11Z)/20:3(8Z,11Z,14Z))[iso6] C57H102O6 PEGBVZIRKWFBAT-FKSNBECISA-N -BMDB63166 880.75199094 TG(14:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H100O6 YJIQPDYUKSNQSN-QXNOUVIVSA-N -BMDB63167 878.736340876 TG(14:0/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H98O6 GLOHBCHVPRPNOV-BQXIPVDISA-N -BMDB63168 906.767641004 TG(14:0/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 LTDAYXRREDMQDW-MIRLHXEKSA-N -BMDB63169 882.767641004 TG(14:0/20:2(11Z,14Z)/20:2(11Z,14Z))[iso3] C57H102O6 NEUKLKKOFRWHDB-GLBWZRIWSA-N -BMDB63170 880.75199094 TG(14:0/20:2(11Z,14Z)/20:3(8Z,11Z,14Z))[iso6] C57H100O6 PCGADUJICVENFJ-GNQIMEJDSA-N -BMDB63171 878.736340876 TG(14:0/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H98O6 YFFIQOSQQILEOJ-IIWHEWEFSA-N -BMDB63172 906.767641004 TG(14:0/20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C59H102O6 GBRCKWHNYQTJKH-PXZIMDMNSA-N -BMDB63173 878.736340876 TG(14:0/20:3(8Z,11Z,14Z)/20:3(8Z,11Z,14Z))[iso3] C57H98O6 QQJPBXBJVWFYAA-RPPRZKKMSA-N -BMDB63174 746.642440489 TG(14:1(9Z)/14:1(9Z)/16:0)[iso3] C47H86O6 MVWPGRQBICMGIE-SCSZFZRQSA-N -BMDB63175 774.673740618 TG(14:1(9Z)/14:1(9Z)/18:0)[iso3] C49H90O6 ULZQTMTWRYWQLC-LTZANOLVSA-N -BMDB63176 802.705040747 TG(14:1(9Z)/14:1(9Z)/20:0)[iso3] C51H94O6 MIFLTTTYYQVJLG-ZYHFKXEVSA-N -BMDB63177 800.689390682 TG(14:1(9Z)/14:1(9Z)/20:1(11Z))[iso3] C51H92O6 BPVUUWFAICALOI-AQZFARFOSA-N -BMDB63178 816.720690811 TG(14:1(9Z)/14:1(9Z)/21:0)[iso3] C52H96O6 LNPLTNXGGPIUPO-JPJOJYBFSA-N -BMDB63179 830.736340876 TG(14:1(9Z)/14:1(9Z)/22:0)[iso3] C53H98O6 KUEBBDIGWKIOKM-HIEAHZGJSA-N -BMDB63180 748.658090554 TG(14:1(9Z)/15:0/15:0)[iso3] C47H88O6 JLZYFORTRUGDQW-YVCFFHMXSA-N -BMDB63181 818.736340876 TG(14:1(9Z)/15:0/20:0)[iso6] C52H98O6 XQGOBCMATVTNTB-FBUBQAPCSA-N -BMDB63182 816.720690811 TG(14:1(9Z)/15:0/20:1(11Z))[iso6] C52H96O6 MXMODTVYMFBFLH-UKSAVOONSA-N -BMDB63183 832.75199094 TG(14:1(9Z)/15:0/21:0)[iso6] C53H100O6 JJYKEXXFKPUKOC-GBDWEMPCSA-N -BMDB63184 846.767641004 TG(14:1(9Z)/15:0/22:0)[iso6] C54H102O6 DZWUIBOQQCZJFO-WAEMFQRBSA-N -BMDB63185 838.705040747 "TG(14:1(9Z)/15:0/22:4(7Z,10Z,13Z,16Z)) [iso6]" C54H94O6 JPKNJGJLOIRIHE-LAIKAHNNSA-N -BMDB63186 774.673740618 TG(14:1(9Z)/16:0/16:1(9Z))[iso6] C49H90O6 XYYRUMPXVOZUGQ-HLWBBGRPSA-N -BMDB63187 802.705040747 TG(14:1(9Z)/16:0/18:1(9Z))[iso6] C51H94O6 IDORTGNLWFUSFB-BEZIXVOXSA-N -BMDB63188 800.689390682 TG(14:1(9Z)/16:0/18:2(9Z,12Z))[iso6] C51H92O6 FHGXTKAXCVLEFT-MIELHLGDSA-N -BMDB63189 818.736340876 TG(14:1(9Z)/16:0/19:0)[iso6] C52H98O6 KLYQJSMEYVGMRD-FBUBQAPCSA-N -BMDB63190 832.75199094 TG(14:1(9Z)/16:0/20:0)[iso6] C53H100O6 AJWXNNCJHGLYAD-GBDWEMPCSA-N -BMDB63191 830.736340876 TG(14:1(9Z)/16:0/20:1(11Z))[iso6] C53H98O6 AXGBRPSHYYTFMZ-YZLGPNATSA-N -BMDB63192 828.720690811 TG(14:1(9Z)/16:0/20:2(11Z,14Z))[iso6] C53H96O6 FKRJLNNLXUZMAE-AWNZXJQSSA-N -BMDB63193 826.705040747 TG(14:1(9Z)/16:0/20:3(8Z,11Z,14Z))[iso6] C53H94O6 QNSGESMEDNONDQ-YEIQNNBGSA-N -BMDB63194 846.767641004 TG(14:1(9Z)/16:0/21:0)[iso6] C54H102O6 XIRVPEQVOKTJKV-WAEMFQRBSA-N -BMDB63195 852.720690811 TG(14:1(9Z)/16:0/22:4(7Z,10Z,13Z,16Z))[iso6] C55H96O6 DJBSAGJERMKCDN-KXXMQWMHSA-N -BMDB63196 802.705040747 TG(14:1(9Z)/16:1(9Z)/18:0)[iso6] C51H94O6 NTJGBLKOLWZBGK-XNBLBITASA-N -BMDB63197 800.689390676 TG(14:1(9Z)/16:1(9Z)/18:1(9Z))[iso6] C51H92O6 ZIGMEVARAPDBLA-ZOFBRCOOSA-N -BMDB63198 816.720690811 TG(14:1(9Z)/16:1(9Z)/19:0)[iso6] C52H96O6 ROOMUDAYHJYWIB-ONIRNZKQSA-N -BMDB63199 830.736340876 TG(14:1(9Z)/16:1(9Z)/20:0)[iso6] C53H98O6 HAHVPPVRPWNLPZ-KBPAKABXSA-N -BMDB63200 828.720690811 TG(14:1(9Z)/16:1(9Z)/20:1(11Z))[iso6] C53H96O6 YJHJUCJUUFLJKP-BREDDCKZSA-N -BMDB63201 826.705040747 TG(14:1(9Z)/16:1(9Z)/20:2(11Z,14Z))[iso6] C53H94O6 BVEHBZABGSQPIA-SALQHMLOSA-N -BMDB63202 844.75199094 TG(14:1(9Z)/16:1(9Z)/21:0)[iso6] C54H100O6 BDILEAGHQOKCJP-SVLPHVQZSA-N -BMDB63203 858.767640996 TG(14:1(9Z)/16:1(9Z)/22:0)[iso6] C55H102O6 KCBONYLTGYLSPQ-ZHYIDQMMSA-N -BMDB63204 818.736340876 TG(14:1(9Z)/17:0/18:0)[iso6] C52H98O6 VQFDARFASMNDPO-FBUBQAPCSA-N -BMDB63205 816.720690811 TG(14:1(9Z)/17:0/18:1(9Z))[iso6] C52H96O6 HNZHNRBGKOGSAN-DZHKDINRSA-N -BMDB63206 832.75199094 TG(14:1(9Z)/17:0/19:0)[iso6] C53H100O6 APHPZTPJTCOKDQ-GBDWEMPCSA-N -BMDB63207 846.767641004 TG(14:1(9Z)/17:0/20:0)[iso6] C54H102O6 SCKSTQYDKBQNEH-WAEMFQRBSA-N -BMDB63208 844.75199094 TG(14:1(9Z)/17:0/20:1(11Z))[iso6] C54H100O6 QRHYOFNHJQTTSH-FDQAFRHVSA-N -BMDB63209 842.736340876 TG(14:1(9Z)/17:0/20:2(11Z,14Z))[iso6] C54H98O6 UDGLXVGUNBGHQK-PVOISTOZSA-N -BMDB63210 840.720690811 TG(14:1(9Z)/17:0/20:3(8Z,11Z,14Z))[iso6] C54H96O6 PDUURVFFFQOEDI-IWKFIRQESA-N -BMDB63211 838.705040747 "TG(14:1(9Z)/17:0/20:4(5Z,8Z,11Z,14Z)) [iso6]" C54H94O6 AXGLIVAXBTUIEL-YOOFFHLWSA-N -BMDB63212 866.736340876 TG(14:1(9Z)/17:0/22:4(7Z,10Z,13Z,16Z))[iso6] C56H98O6 UULXTJKQOCFMPP-JGGPMCPVSA-N -BMDB63213 864.720690811 TG(14:1(9Z)/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 UZMFTVFOAGQKNA-KBRNEGTESA-N -BMDB63214 832.75199094 TG(14:1(9Z)/18:0/18:0)[iso3] C53H100O6 BUBDIXSZFBSPDV-GBDWEMPCSA-N -BMDB63215 830.736340876 TG(14:1(9Z)/18:0/18:1(9Z))[iso6] C53H98O6 BWIZOVWGSXRELH-LRIYWTGSSA-N -BMDB63216 828.720690811 TG(14:1(9Z)/18:0/18:2(9Z,12Z))[iso6] C53H96O6 YZIMSURFZCBEPK-ZKKQPWQBSA-N -BMDB63217 826.705040747 TG(14:1(9Z)/18:0/18:3(6Z,9Z,12Z))[iso6] C53H94O6 JJJFPSASDJDBAA-GAKSGLJASA-N -BMDB63218 826.705040747 TG(14:1(9Z)/18:0/18:3(9Z,12Z,15Z))[iso6] C53H94O6 AHFFBXZSVOKSCA-FAFQATKSSA-N -BMDB63219 846.767641004 TG(14:1(9Z)/18:0/19:0)[iso6] C54H102O6 HVZCGYSSADENBO-WAEMFQRBSA-N -BMDB63220 858.767641004 TG(14:1(9Z)/18:0/20:1(11Z))[iso6] C55H102O6 SJZMAXZPHJKFLA-CSOMECLSSA-N -BMDB63221 856.75199094 TG(14:1(9Z)/18:0/20:2(11Z,14Z))[iso6] C55H100O6 FSTDLLFKLQLNCY-INLODCDNSA-N -BMDB63222 854.736340876 TG(14:1(9Z)/18:0/20:3(8Z,11Z,14Z))[iso6] C55H98O6 FRRFYNPAOJOMTG-UDDBTJMSSA-N -BMDB63223 852.720690811 TG(14:1(9Z)/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H96O6 LMDMXKYAEKPMRJ-HMTDPXOMSA-N -BMDB63224 880.75199094 TG(14:1(9Z)/18:0/22:4(7Z,10Z,13Z,16Z))[iso6] C57H100O6 FAEIJJBFHNTKST-UOWISKSOSA-N -BMDB63225 878.736340876 TG(14:1(9Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 XEMKEHAWVGNINA-YBYRLAKVSA-N -BMDB63226 828.720690811 TG(14:1(9Z)/18:1(9Z)/18:1(9Z))[iso3] C53H96O6 LSIWIEMBUWTAAQ-LGIGGLQBSA-N -BMDB63227 826.705040747 TG(14:1(9Z)/18:1(9Z)/18:2(9Z,12Z))[iso6] C53H94O6 OXTWVCYSQAJXLY-UYVNSICISA-N -BMDB63228 844.75199094 TG(14:1(9Z)/18:1(9Z)/19:0)[iso6] C54H100O6 ZIELCAYILYZIOC-KHBXOQJOSA-N -BMDB63229 858.767641004 TG(14:1(9Z)/18:1(9Z)/20:0)[iso6] C55H102O6 QGSLOGGZIMGOJQ-KOTIVLSZSA-N -BMDB63230 856.75199094 TG(14:1(9Z)/18:1(9Z)/20:1(11Z))[iso6] C55H100O6 RYWWBXHDEGSCOG-MFCAIVPXSA-N -BMDB63231 854.736340876 TG(14:1(9Z)/18:1(9Z)/20:2(11Z,14Z))[iso6] C55H98O6 YWEWSQJHNNUANW-CNJXFFONSA-N -BMDB63232 852.720690811 TG(14:1(9Z)/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C55H96O6 CGPMDMDZQFZLHH-ANKMCOSDSA-N -BMDB63233 886.798941133 TG(14:1(9Z)/18:1(9Z)/22:0)[iso6] C57H106O6 XQGOXUBPPLKVPV-FLHZLDQWSA-N -BMDB63234 878.736340876 TG(14:1(9Z)/18:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H98O6 PSXVDMHVIJTXKU-CATITTJPSA-N -BMDB63235 842.736340876 TG(14:1(9Z)/18:2(9Z,12Z)/19:0)[iso6] C54H98O6 PMWHTYYQOBMMGG-VIBZLMJOSA-N -BMDB63236 856.75199094 TG(14:1(9Z)/18:2(9Z,12Z)/20:0)[iso6] C55H100O6 SESIDPZYQNXGDB-MMLIVBKMSA-N -BMDB63237 854.736340876 TG(14:1(9Z)/18:2(9Z,12Z)/20:1(11Z))[iso6] C55H98O6 RXDPGFFVSMSLTG-WOVOSWEDSA-N -BMDB63238 852.720690811 TG(14:1(9Z)/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C55H96O6 FHMSYFQZXWGGAR-OQULKOOXSA-N -BMDB63239 870.767641004 TG(14:1(9Z)/18:2(9Z,12Z)/21:0)[iso6] C56H102O6 MFKVUWLZFLRRSL-XLPOXEFRSA-N -BMDB63240 884.783291069 TG(14:1(9Z)/18:2(9Z,12Z)/22:0)[iso6] C57H104O6 FYOAFNBAIZJVFT-NTJLCKQPSA-N -BMDB63241 840.720690811 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/19:0)[iso6] C54H96O6 FXJDGSNNOJGERK-HFVPBBBCSA-N -BMDB63242 854.736340876 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/20:0)[iso6] C55H98O6 MGSBTOPMZSCVHO-BZELGPTESA-N -BMDB63243 852.720690811 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C55H96O6 PHSOZYZQNQNQAK-AKERPWBHSA-N -BMDB63244 868.75199094 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/21:0)[iso6] C56H100O6 HJALBBWEPPAQQG-OSTKVNFSSA-N -BMDB63245 882.767641004 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/22:0)[iso6] C57H102O6 OOXHPYMTHPKODA-FGMJLWFOSA-N -BMDB63246 840.720690811 TG(14:1(9Z)/18:3(9Z,12Z,15Z)/19:0)[iso6] C54H96O6 SJQMHIAHRCGOFO-WFBMQPNDSA-N -BMDB63247 854.736340876 TG(14:1(9Z)/18:3(9Z,12Z,15Z)/20:0)[iso6] C55H98O6 WZFPPHDQBDNLNK-UHDSONINSA-N -BMDB63248 852.720690811 TG(14:1(9Z)/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C55H96O6 DSZMYGQJZQQSEL-LTASUQRYSA-N -BMDB63249 868.75199094 TG(14:1(9Z)/18:3(9Z,12Z,15Z)/21:0)[iso6] C56H100O6 YCBCZIKALKDHRL-RNRXTGNKSA-N -BMDB63250 882.767641004 TG(14:1(9Z)/18:3(9Z,12Z,15Z)/22:0)[iso6] C57H102O6 QEYIHHBEALJAPR-ROXUKPIWSA-N -BMDB63251 838.705040747 "TG(14:1(9Z)/18:4(6Z,9Z,12Z,15Z)/19:0) [iso6]" C54H94O6 OJQOQQTYZNUQEO-VLTOWSMBSA-N -BMDB63252 852.720690811 TG(14:1(9Z)/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C55H96O6 AYBNKZOBZIRMHJ-WCCWLRMCSA-N -BMDB63253 866.736340876 TG(14:1(9Z)/18:4(6Z,9Z,12Z,15Z)/21:0)[iso6] C56H98O6 OPTAVPDYKMZZIU-YAMQLDASSA-N -BMDB63254 880.75199094 TG(14:1(9Z)/18:4(6Z,9Z,12Z,15Z)/22:0)[iso6] C57H100O6 IHSDKTOLZNRUIJ-PCXGZXBVSA-N -BMDB63255 870.767641004 TG(14:1(9Z)/19:0/20:2(11Z,14Z))[iso6] C56H102O6 DWRFRVMLGKZEFL-GTWSWVPXSA-N -BMDB63256 868.75199094 TG(14:1(9Z)/19:0/20:3(8Z,11Z,14Z))[iso6] C56H100O6 AGGMHSIJPOCJNC-MASVKUGQSA-N -BMDB63257 866.736340876 TG(14:1(9Z)/19:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H98O6 UIRMRFWTYIILMR-KRGWTCCISA-N -BMDB63258 864.720690811 TG(14:1(9Z)/19:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H96O6 BNZDKHVWOHULBW-LNYCIMOMSA-N -BMDB63259 892.75199094 TG(14:1(9Z)/19:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 PEFALGWSGDTGFP-LEGBOPRUSA-N -BMDB63260 890.736340876 TG(14:1(9Z)/19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 HPIZLBYYGOCKAC-BPRBUCARSA-N -BMDB63261 886.798941133 TG(14:1(9Z)/20:0/20:1(11Z))[iso6] C57H106O6 SSHQULTWICGVDD-VADMYHFGSA-N -BMDB63262 884.783291069 TG(14:1(9Z)/20:0/20:2(11Z,14Z))[iso6] C57H104O6 NUYRINJQOPQTKC-VZKMDISCSA-N -BMDB63263 882.767641004 TG(14:1(9Z)/20:0/20:3(8Z,11Z,14Z))[iso6] C57H102O6 AUEYCFPJLUPBLD-BJTIWZRUSA-N -BMDB63264 880.75199094 TG(14:1(9Z)/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H100O6 FCJIOGHLJHBKRR-RRSYUMOYSA-N -BMDB63265 878.736340876 TG(14:1(9Z)/20:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H98O6 MRADHNGGQNMBIT-QZSXXDLCSA-N -BMDB63266 906.767641004 TG(14:1(9Z)/20:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 HHOXMNWYACDQOZ-KSVLYWAXSA-N -BMDB63267 884.783291069 TG(14:1(9Z)/20:1(11Z)/20:1(11Z))[iso3] C57H104O6 OPZBOXKFTDVAOR-LIFHANCPSA-N -BMDB63268 882.767641004 TG(14:1(9Z)/20:1(11Z)/20:2(11Z,14Z))[iso6] C57H102O6 BGODCVGWEBYLGN-IQKRTTMSSA-N -BMDB63269 880.75199094 TG(14:1(9Z)/20:1(11Z)/20:3(8Z,11Z,14Z))[iso6] C57H100O6 BCMHHAAVHIRHKO-UMNWWONZSA-N -BMDB63270 878.736340876 TG(14:1(9Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C57H98O6 FWEYWBCVKNAPDM-CWNCTSIJSA-N -BMDB63271 906.767641004 TG(14:1(9Z)/20:1(11Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C59H102O6 OVLIJZSOJQWFEB-YGXKXHDLSA-N -BMDB63272 880.75199094 TG(14:1(9Z)/20:2(11Z,14Z)/20:2(11Z,14Z))[iso3] C57H100O6 GGESIZJOLUZGHM-FRWMMZKASA-N -BMDB63273 878.736340876 TG(14:1(9Z)/20:2(11Z,14Z)/20:3(8Z,11Z,14Z))[iso6] C57H98O6 GTWVWZVUHRQRBY-NKVDYPCKSA-N -BMDB63274 892.75199094 TG(14:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/21:0)[iso6] C58H100O6 TXGHWDWVTGGXMQ-FVAAAGHZSA-N -BMDB63275 906.767641004 TG(14:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:0)[iso6] C59H102O6 WYXOGHYUVBJXHY-MMPZXVEESA-N -BMDB63276 802.705040747 TG(15:0/15:0/18:2(9Z,12Z))[iso3] C51H94O6 QMWRBKDPURNASG-CUKHCRPOSA-N -BMDB63277 800.689390682 TG(15:0/15:0/18:3(6Z,9Z,12Z))[iso3] C51H92O6 METHLKWLLGWOAR-RDSZMISUSA-N -BMDB63278 800.689390682 TG(15:0/15:0/18:3(9Z,12Z,15Z))[iso3] C51H92O6 IMUJVKCHSCPLJO-BTTTWFIISA-N -BMDB63279 832.75199094 TG(15:0/15:0/20:1(11Z))[iso3] C53H100O6 CTTGQUYMPWGUTF-YYSBDVFPSA-N -BMDB63280 830.736340876 TG(15:0/15:0/20:2(11Z,14Z))[iso3] C53H98O6 OEGSGUSCNRLRFO-IICCMCGVSA-N -BMDB63281 828.720690811 TG(15:0/15:0/20:3(8Z,11Z,14Z))[iso3] C53H96O6 USKOQXWFTGKIJK-RAYTXGKKSA-N -BMDB63282 826.705040747 TG(15:0/15:0/20:4(5Z,8Z,11Z,14Z))[iso3] C53H94O6 GOBILVAUGMTLQK-OXUNUDIPSA-N -BMDB63283 854.736340876 TG(15:0/15:0/22:4(7Z,10Z,13Z,16Z))[iso3] C55H98O6 OHCSUIXLCHKFFY-NQDHGGPDSA-N -BMDB63284 852.720690811 TG(15:0/15:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso3] C55H96O6 CKJFKCABBRYLMR-UJAGEWJNSA-N -BMDB63285 818.736340876 TG(15:0/16:0/18:1(9Z))[iso6] C52H98O6 IVRUJYRTYXTTIH-WURLXDQTSA-N -BMDB63286 816.720690811 TG(15:0/16:0/18:2(9Z,12Z))[iso6] C52H96O6 DDWAXVHDVUVXSQ-XASORYIHSA-N -BMDB63287 846.767641004 TG(15:0/16:0/20:1(11Z))[iso6] C54H102O6 SUYGGHGLHBZSPT-BPHZLQOLSA-N -BMDB63288 838.705040747 "TG(15:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) [iso6]" C54H94O6 AMXXNFGRYHWAIZ-YSWGSRGVSA-N -BMDB63289 868.75199094 TG(15:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso6] C56H100O6 AHARKWTZAVEXCY-QAHZJOAVSA-N -BMDB63290 866.736340876 TG(15:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H98O6 QBWWHOKPBJFJMT-HBTQITAKSA-N -BMDB63291 864.720690811 TG(15:0/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 LDWHFXYROBXTCC-XCXLAPNFSA-N -BMDB63292 818.736340876 TG(15:0/16:1(9Z)/18:0)[iso6] C52H98O6 IPTNYCRHJMJCQE-KMTXBVSESA-N -BMDB63293 816.720690811 TG(15:0/16:1(9Z)/18:1(9Z))[iso6] C52H96O6 ZSHVDBVWHRXKEV-KEJUFOLESA-N -BMDB63294 832.75199094 TG(15:0/16:1(9Z)/19:0)[iso6] C53H100O6 LWRQEQMKDSSHAL-DKKVYINCSA-N -BMDB63295 846.767641004 TG(15:0/16:1(9Z)/20:0)[iso6] C54H102O6 VCVDKBBECJTNHK-FECCDXIYSA-N -BMDB63296 844.75199094 TG(15:0/16:1(9Z)/20:1(11Z))[iso6] C54H100O6 XJHCUGZLVVQPLJ-ZULIWAOTSA-N -BMDB63297 842.736340876 TG(15:0/16:1(9Z)/20:2(11Z,14Z))[iso6] C54H98O6 NAFMESDUMVNTKX-ABXSMWFCSA-N -BMDB63298 840.720690811 TG(15:0/16:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C54H96O6 ZBLICBPFGHXTDO-SAMZCZMDSA-N -BMDB63299 838.705040747 "TG(15:0/16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) [iso6]" C54H94O6 HVWSSTSBNGXYBJ-NEUYFDHMSA-N -BMDB63300 866.736340876 TG(15:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C56H98O6 PZJGYRZVYVHCDI-QRDZVSGTSA-N -BMDB63301 864.720690811 TG(15:0/16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C56H96O6 LQWIUBUSZHRBMR-PUHDPVPQSA-N -BMDB63302 832.75199094 TG(15:0/17:0/18:1(9Z))[iso6] C53H100O6 DRKYQWMKUPUUSK-RXQRVFRESA-N -BMDB63303 830.736340876 TG(15:0/17:0/18:2(9Z,12Z))[iso6] C53H98O6 LXTHWHPSRIYNDA-OOYOYISSSA-N -BMDB63304 828.720690811 TG(15:0/17:0/18:3(6Z,9Z,12Z))[iso6] C53H96O6 NSCSMJBBZBCZPA-ONYZMOOJSA-N -BMDB63305 828.720690811 TG(15:0/17:0/18:3(9Z,12Z,15Z))[iso6] C53H96O6 BVNVQKCUSUQOBS-GCLHFNBGSA-N -BMDB63306 826.705040747 TG(15:0/17:0/18:4(6Z,9Z,12Z,15Z))[iso6] C53H94O6 ODQQQBWNNQQHDC-VFDWZYNKSA-N -BMDB63307 858.767641004 TG(15:0/17:0/20:2(11Z,14Z))[iso6] C55H102O6 HLKXUQWBLARRKN-AXYZMXSISA-N -BMDB63308 856.75199094 TG(15:0/17:0/20:3(8Z,11Z,14Z))[iso6] C55H100O6 YVOALKUYMOCTRZ-PALQDYBESA-N -BMDB63309 854.736340876 TG(15:0/17:0/20:4(5Z,8Z,11Z,14Z))[iso6] C55H98O6 BRONEPJOIBPQAU-QQLQNIADSA-N -BMDB63310 852.720690811 TG(15:0/17:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C55H96O6 GXKIOFVYMGPCNW-IOKBHKOWSA-N -BMDB63311 882.767641004 TG(15:0/17:0/22:4(7Z,10Z,13Z,16Z))[iso6] C57H102O6 WIYNEVGMEDLXJC-NWOIPSGQSA-N -BMDB63312 880.75199094 TG(15:0/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H100O6 QGPKJIDZWXVWHS-QKIMVFCSSA-N -BMDB63313 878.736340876 TG(15:0/17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 AGRWQVDHBRTOBQ-FKOMLZBPSA-N -BMDB63314 846.767641004 TG(15:0/18:0/18:1(9Z))[iso6] C54H102O6 NTCKBJDZYIUTCZ-IWRJKWNLSA-N -BMDB63315 842.736340876 TG(15:0/18:0/18:3(6Z,9Z,12Z))[iso6] C54H98O6 OGNCECWXMXWFGY-HUKRJYENSA-N -BMDB63316 840.720690811 TG(15:0/18:0/18:4(6Z,9Z,12Z,15Z))[iso6] C54H96O6 IVTXWAOVGPUCRC-GJEOUJQTSA-N -BMDB63317 870.767641004 TG(15:0/18:0/20:3(8Z,11Z,14Z))[iso6] C56H102O6 ALQRRLJPYXJUQJ-RSTIMVJUSA-N -BMDB63318 868.75199094 TG(15:0/18:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H100O6 YNBYDMOKHWTIOZ-AMXMSOOLSA-N -BMDB63319 866.736340876 TG(15:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H98O6 ZXBWNEVRFREORM-PISIRZHQSA-N -BMDB63320 892.75199094 TG(15:0/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 XLKRJIDQNKJANA-BCQSDSNRSA-N -BMDB63321 840.720690811 TG(15:0/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C54H96O6 IJTQTIQOHKQXGY-VVYUWGEOSA-N -BMDB63322 838.705040747 "TG(15:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) [iso6]" C54H94O6 ZTMUXDIXBIPXGU-PZVZAQIJSA-N -BMDB63323 870.767641004 TG(15:0/18:1(9Z)/20:2(11Z,14Z))[iso6] C56H102O6 ANIZQXYZMABPHZ-KYTYZABYSA-N -BMDB63324 868.75199094 TG(15:0/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C56H100O6 AVNIVQNKHXFYSN-URCKJTPXSA-N -BMDB63325 866.736340876 TG(15:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C56H98O6 HEBGSKDYZDHLCX-VVBUWLPMSA-N -BMDB63326 864.720690811 TG(15:0/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H96O6 OCLMKYADRKWPHX-AECXCSJASA-N -BMDB63327 892.75199094 TG(15:0/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 GQEDWGPIIPNXKK-CDISXQGSSA-N -BMDB63328 890.736340876 TG(15:0/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 NJBABWLQKGRDHS-PXLGKYGTSA-N -BMDB63329 838.705040747 "TG(15:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) [iso6]" C54H94O6 KPOZERFMPPBKLU-MXUWZVGSSA-N -BMDB63330 838.705040747 "TG(15:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) [iso6]" C54H94O6 VEGWTLAYXMHOLL-HGHNBNCWSA-N -BMDB63331 858.767641004 TG(15:0/18:2(9Z,12Z)/19:0)[iso6] C55H102O6 FWKDGRXQEDHKNC-MXIZALJSSA-N -BMDB63332 870.767641004 TG(15:0/18:2(9Z,12Z)/20:1(11Z))[iso6] C56H102O6 RHODOWWOHRDFEP-AJWXWBAVSA-N -BMDB63333 868.75199094 TG(15:0/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C56H100O6 BLQBYZAEDJFOQJ-XEHHIRGYSA-N -BMDB63334 866.736340876 TG(15:0/18:2(9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C56H98O6 CKBVNPDRXAQXPC-AHPJETTOSA-N -BMDB63335 864.720690811 TG(15:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C56H96O6 XVHLGBHSAWAQOP-VCFUQMKTSA-N -BMDB63336 886.798941133 TG(15:0/18:2(9Z,12Z)/21:0)[iso6] C57H106O6 PZCDMYGPUPHCML-HLPKYJTRSA-N -BMDB63337 892.75199094 TG(15:0/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H100O6 RLUPWQZSNHDVDN-PGZMEBPCSA-N -BMDB63338 890.736340876 TG(15:0/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 DBLWBMOGRRODGG-GCKQKNAVSA-N -BMDB63339 888.720690811 TG(15:0/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H96O6 CCWZMJPDSMVFGX-QEOYEMERSA-N -BMDB63340 856.75199094 TG(15:0/18:3(6Z,9Z,12Z)/19:0)[iso6] C55H100O6 HUJICKOFNHWLNH-SDNOKDSYSA-N -BMDB63341 870.767641004 TG(15:0/18:3(6Z,9Z,12Z)/20:0)[iso6] C56H102O6 SFXPGNOTVPCLGV-YQACDRHUSA-N -BMDB63342 868.75199094 TG(15:0/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C56H100O6 NVPVWAAYLOXLNU-RILZXJDUSA-N -BMDB63343 866.736340876 TG(15:0/18:3(6Z,9Z,12Z)/20:2(11Z,14Z))[iso6] C56H98O6 QHZCBHXUZKDICC-JZRNRQSTSA-N -BMDB63344 864.720690811 TG(15:0/18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C56H96O6 FZRSKGVAJUEIMB-ZNMYJKAFSA-N -BMDB63345 884.783291069 TG(15:0/18:3(6Z,9Z,12Z)/21:0)[iso6] C57H104O6 KWVJBVNSQMDXOA-WHXRBJOXSA-N -BMDB63346 890.736340876 TG(15:0/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H98O6 LBVQZZXEQAQWJE-FCTCNIKJSA-N -BMDB63347 888.720690811 TG(15:0/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H96O6 WBENTTBFGOYZBK-BQMFVZMCSA-N -BMDB63348 886.705040747 TG(15:0/18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H94O6 SNFNQOYAAAMVDM-ZVJXPZCRSA-N -BMDB63349 856.75199094 TG(15:0/18:3(9Z,12Z,15Z)/19:0)[iso6] C55H100O6 NZUFUYUQOXNGHK-XKCLUBGVSA-N -BMDB63350 870.767641004 TG(15:0/18:3(9Z,12Z,15Z)/20:0)[iso6] C56H102O6 AWTWWJICEHSIQB-APGUVPFOSA-N -BMDB63351 868.75199094 TG(15:0/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C56H100O6 SSECMEVMCYXEDX-UGFDWAJZSA-N -BMDB63352 866.736340876 TG(15:0/18:3(9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C56H98O6 SXJDBDBUWNMJQG-XEZWFYPASA-N -BMDB63353 864.720690811 TG(15:0/18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z))[iso6] C56H96O6 SXYZPDVKPZSYBB-GSDDELAMSA-N -BMDB63354 884.783291069 TG(15:0/18:3(9Z,12Z,15Z)/21:0)[iso6] C57H104O6 HKYKVKLJKOMEFB-VCZQZVNISA-N -BMDB63355 890.736340876 TG(15:0/18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H98O6 RXWNEDBINLPSKT-DTPXRKDSSA-N -BMDB63356 888.720690811 TG(15:0/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H96O6 XSNULRLGLPOPAW-RLUXLQEASA-N -BMDB63357 886.705040747 TG(15:0/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H94O6 ZSHNGOFHXDJETR-OCJVAEQXSA-N -BMDB63358 854.736340876 TG(15:0/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C55H98O6 SCNIQPJMPXCRBL-SJOAMKAZSA-N -BMDB63359 868.75199094 TG(15:0/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C56H100O6 XHGPJDAXTQRYRX-IFYWJLRBSA-N -BMDB63360 866.736340876 TG(15:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z))[iso6] C56H98O6 ILVHTHLVGOKSIS-BIHBSHSGSA-N -BMDB63361 864.720690811 TG(15:0/18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C56H96O6 WOGKPIGFDQNJSC-VWQGHMRWSA-N -BMDB63362 882.767641004 TG(15:0/18:4(6Z,9Z,12Z,15Z)/21:0)[iso6] C57H102O6 LNPZFXQJIKGHQU-GHNRJVLESA-N -BMDB63363 888.720690811 TG(15:0/18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C58H96O6 QCBQGJYOLYSRFB-MBIARFDPSA-N -BMDB63364 886.705040747 TG(15:0/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H94O6 UQPZYNPQGAQLOZ-STHTUCCFSA-N -BMDB63365 886.798941133 TG(15:0/19:0/20:2(11Z,14Z))[iso6] C57H106O6 DIEUHKAOXWVENP-SPSCBPQESA-N -BMDB63366 884.783291069 TG(15:0/19:0/20:3(8Z,11Z,14Z))[iso6] C57H104O6 HFLBNRZGYPBDNR-YRQBPDLFSA-N -BMDB63367 882.767641004 TG(15:0/19:0/20:4(5Z,8Z,11Z,14Z))[iso6] C57H102O6 RFIMOUDBNYZGQQ-YMCONJMYSA-N -BMDB63368 880.75199094 TG(15:0/19:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H100O6 IAIXCANGXJKPPC-ZNJNHKNHSA-N -BMDB63369 906.767641004 TG(15:0/19:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 AOHKDMQJILOQIT-DNORJDIWSA-N -BMDB63370 892.75199094 TG(15:0/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H100O6 YYJJTSKFEAOXSI-JCWDJJCISA-N -BMDB63371 892.75199094 TG(15:0/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H100O6 YRIVSXDJQGUUPE-YKUPGGRVSA-N -BMDB63372 890.736340876 TG(15:0/20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H98O6 NOZRDRCGJNYJAG-FZOHNITLSA-N -BMDB63373 892.75199094 TG(15:0/20:3(8Z,11Z,14Z)/20:3(8Z,11Z,14Z))[iso3] C58H100O6 VNKFJQDGOLFDBJ-AVDNXWPCSA-N -BMDB63374 890.736340876 TG(15:0/20:3(8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H98O6 FNKJYZHOCLKKOQ-SVAQYVQNSA-N -BMDB63375 888.720690811 TG(15:0/20:3(8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H96O6 ZYYQFIVTVYQHRI-NBRMABAVSA-N -BMDB63376 888.720690811 TG(15:0/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso3] C58H96O6 WGBLYIVQHHBSJP-FVZMLJHESA-N -BMDB63377 886.705040747 TG(15:0/20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H94O6 MZMDWTSJLXIFQW-KCQCUMLUSA-N -BMDB63378 832.75199094 TG(16:0/16:0/18:1(11E)) C53H100O6 ZKEWGTVAIGJNBK-WTHOFYOTSA-N -BMDB63379 832.751990932 TG(16:0/16:0/18:1(9Z)) C53H100O6 YHMDGPZOSGBQRH-YYSBDVFPSA-N -BMDB63380 828.720690811 TG(16:0/16:0/18:3(6Z,9Z,12Z))[iso3] C53H96O6 SDAWBYTVEHZEOC-UYELOTJWSA-N -BMDB63381 826.705040747 TG(16:0/16:0/18:4(6Z,9Z,12Z,15Z))[iso3] C53H94O6 BKTGCNHANLSVFZ-SSWDCBAISA-N -BMDB63382 858.767641004 TG(16:0/16:0/20:2(11Z,14Z))[iso3] C55H102O6 LYMKCBJXTOVQAA-WGAYFDSDSA-N -BMDB63383 856.75199094 TG(16:0/16:0/20:3(8Z,11Z,14Z))[iso3] C55H100O6 QREQPUUUIPJTAA-HYCWKOKOSA-N -BMDB63384 852.720690811 TG(16:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso3] C55H96O6 MKRZSXAKFYWUAW-QMMDPMFKSA-N -BMDB63385 882.767641004 TG(16:0/16:0/22:4(7Z,10Z,13Z,16Z))[iso3] C57H102O6 MZUGAQXXWDXZIR-CXRAQCBMSA-N -BMDB63386 880.75199094 TG(16:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso3] C57H100O6 JKYPCWURBUPJMX-QWJGYMLASA-N -BMDB63387 818.736340876 TG(16:0/16:1(9Z)/17:0)[iso6] C52H98O6 YIGDTOYHCVNXSG-WIUOTLMHSA-N -BMDB63388 826.705040747 TG(16:0/16:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C53H94O6 SWRIYMPOMOLLBH-GCNOXSMISA-N -BMDB63389 826.705040747 TG(16:0/16:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C53H94O6 RHUJINIOQZVHBP-OANVKHJTSA-N -BMDB63390 846.767641004 TG(16:0/16:1(9Z)/19:0)[iso6] C54H102O6 FSMDNWIRUAZATF-PLQIPONWSA-N -BMDB63391 856.75199094 TG(16:0/16:1(9Z)/20:2(11Z,14Z))[iso6] C55H100O6 QDDBVRCUCSETRT-HKGVRYHUSA-N -BMDB63392 854.736340876 TG(16:0/16:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C55H98O6 SUSIMFZQHRKHPM-MSEPBEHBSA-N -BMDB63393 886.798941133 TG(16:0/16:1(9Z)/22:1(13Z))[iso6] C57H106O6 FNTIMIABTDJKKH-AYBAZDROSA-N -BMDB63394 880.75199094 TG(16:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C57H100O6 JULWPANCJCTRDN-XDVJHDGOSA-N -BMDB63395 878.736340876 TG(16:0/16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C57H98O6 VKAYDSJZVUXKJK-FMDDEYBESA-N -BMDB63396 846.767641004 TG(16:0/17:0/18:1(9Z))[iso6] C54H102O6 RHDRMOUSDQDVCE-IWRJKWNLSA-N -BMDB63397 844.75199094 TG(16:0/17:0/18:2(9Z,12Z))[iso6] C54H100O6 YQTVDFFNLVLBEJ-TXWVTNJISA-N -BMDB63398 842.736340876 TG(16:0/17:0/18:3(6Z,9Z,12Z))[iso6] C54H98O6 ZVSBVHDDAXBCMJ-HUKRJYENSA-N -BMDB63399 842.736340876 TG(16:0/17:0/18:3(9Z,12Z,15Z))[iso6] C54H98O6 STMGIZUULVJEFT-ZCTUBHHNSA-N -BMDB63400 840.720690811 TG(16:0/17:0/18:4(6Z,9Z,12Z,15Z))[iso6] C54H96O6 LBKSXTMDJCVOMT-GJEOUJQTSA-N -BMDB63401 870.767641004 TG(16:0/17:0/20:3(8Z,11Z,14Z))[iso6] C56H102O6 RRXRQXCJWQRGHZ-CBUIXCTPSA-N -BMDB63402 868.75199094 TG(16:0/17:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H100O6 WQFNYIJLJYJWKK-RKCSJCDQSA-N -BMDB63403 866.736340876 TG(16:0/17:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H98O6 LDZJXIQSQMRKGI-NMNASCPOSA-N -BMDB63404 892.75199094 TG(16:0/17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 AFOLAZWOEZYEBM-PNXBFWNTSA-N -BMDB63405 856.75199094 TG(16:0/18:0/18:3(6Z,9Z,12Z))[iso6] C55H100O6 SHZPWJWHCSZOEX-LNQXMCLDSA-N -BMDB63406 856.75199094 TG(16:0/18:0/18:3(9Z,12Z,15Z))[iso6] C55H100O6 QRLNWUKVSNTXQG-KORYJFEASA-N -BMDB63407 854.736340876 TG(16:0/18:0/18:4(6Z,9Z,12Z,15Z))[iso6] C55H98O6 DKOLNIRGGQSZQS-WWVQZGQBSA-N -BMDB63408 886.798941133 TG(16:0/18:0/20:2(11Z,14Z))[iso6] C57H106O6 IVNMDNGRUSIGST-SPSCBPQESA-N -BMDB63409 884.783291069 TG(16:0/18:0/20:3(8Z,11Z,14Z))[iso6] C57H104O6 FAWROKQWRPDLOA-LWFFWPLASA-N -BMDB63410 880.75199094 TG(16:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H100O6 WGKBXGXZUVULLG-YWSSWCCTSA-N -BMDB63411 906.767641004 TG(16:0/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 FXRPCDPGZXCYFO-URLGBJIISA-N -BMDB63412 854.736340876 TG(16:0/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C55H98O6 ZZYGNXBDVZTTTC-HPABRVSLSA-N -BMDB63413 854.736340876 TG(16:0/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C55H98O6 HMIFBOVAIYAEFO-HPUGMXJKSA-N -BMDB63414 852.720690811 TG(16:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z))[iso6] C55H96O6 WZPQAQGIOSQQKF-FXYJTYFCSA-N -BMDB63415 884.783291069 TG(16:0/18:1(9Z)/20:2(11Z,14Z))[iso6] C57H104O6 JQSCFVCYBPEHML-FQZFDGJESA-N -BMDB63416 882.767641004 TG(16:0/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C57H102O6 XSESJUIKHHMUIV-YKSSUTHUSA-N -BMDB63417 878.736340876 TG(16:0/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H98O6 UWGNMVQVXFWGDQ-HGRKZAAOSA-N -BMDB63418 906.767641004 TG(16:0/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 PIUUVQYTIKPYIJ-DQZXQKPZSA-N -BMDB63419 852.720690811 TG(16:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z))[iso6] C55H96O6 PWAOXOJAJJJACV-OZKNWNTQSA-N -BMDB63420 852.720690811 TG(16:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C55H96O6 MVAGPZSVOSGBMR-QCSLZTMBSA-N -BMDB63421 882.767641004 TG(16:0/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C57H102O6 BAJHYMHNWFZWKC-BGIXKNGDSA-N -BMDB63422 880.75199094 TG(16:0/18:2(9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C57H100O6 UWIJLBUWLZZSBQ-HPSHXTDLSA-N -BMDB63423 906.767641004 TG(16:0/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C59H102O6 AHWNOAGNHSGYCM-DNYOHQOYSA-N -BMDB63424 870.767641004 TG(16:0/18:3(6Z,9Z,12Z)/19:0)[iso6] C56H102O6 MMIUAFXTHLIRFK-VMCCCXHFSA-N -BMDB63425 884.783291069 TG(16:0/18:3(6Z,9Z,12Z)/20:0)[iso6] C57H104O6 SAKURFWWZUPUGR-IKGQCQCDSA-N -BMDB63426 882.767641004 TG(16:0/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C57H102O6 ATZQIXHEMLCJGM-VGOFJGDUSA-N -BMDB63427 880.75199094 TG(16:0/18:3(6Z,9Z,12Z)/20:2(11Z,14Z))[iso6] C57H100O6 OLDVVLPHLVANLD-ODFJVYEESA-N -BMDB63428 878.736340876 TG(16:0/18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C57H98O6 GPWKFLDDTKOSOY-CREDTSOHSA-N -BMDB63429 870.767641004 TG(16:0/18:3(9Z,12Z,15Z)/19:0)[iso6] C56H102O6 BEMBZEMYDNQORJ-BBGBDTNPSA-N -BMDB63430 884.783291069 TG(16:0/18:3(9Z,12Z,15Z)/20:0)[iso6] C57H104O6 QMOIIDCAFLCLKL-DXRFALFFSA-N -BMDB63431 882.767641004 TG(16:0/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C57H102O6 PDTAQKYFJJGDCD-YKXTZBHWSA-N -BMDB63432 880.75199094 TG(16:0/18:3(9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C57H100O6 QUFRRPUAEDKDEW-CYNWPRIGSA-N -BMDB63433 878.736340876 TG(16:0/18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z))[iso6] C57H98O6 RCTFSXXAFDXOOG-ZHQRDAHOSA-N -BMDB63434 868.75199094 TG(16:0/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C56H100O6 JLEBZIDXBSPVEI-HSAZZYPISA-N -BMDB63435 882.767641004 TG(16:0/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C57H102O6 PDFFYHNLAKMFAW-VRQFSDKGSA-N -BMDB63436 880.75199094 TG(16:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z))[iso6] C57H100O6 VWRXQZKIYNYMGG-RZIQDICVSA-N -BMDB63437 878.736340876 TG(16:0/18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C57H98O6 QUYHARLNKAANBC-MIFDXABCSA-N -BMDB63438 906.767641004 TG(16:0/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C59H102O6 SSGHUNZCTBPNHZ-WDBPRSLVSA-N -BMDB63439 906.767641004 TG(16:0/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C59H102O6 KOKYYOZUDSMORZ-RVOKLDRWSA-N -BMDB63440 906.767641004 TG(16:0/20:3(8Z,11Z,14Z)/20:3(8Z,11Z,14Z))[iso3] C59H102O6 IEFYSGXZIYBWNF-TYZDOYEVSA-N -BMDB63441 816.720690811 TG(16:1(9Z)/16:1(9Z)/17:0)[iso3] C52H96O6 QZYSUBAQYSVFNX-PSMULLBHSA-N -BMDB63442 844.75199094 TG(16:1(9Z)/16:1(9Z)/19:0)[iso3] C54H100O6 RCTFXDPMSHIQTH-LFMSVABCSA-N -BMDB63443 854.736340876 TG(16:1(9Z)/16:1(9Z)/20:2(11Z,14Z))[iso3] C55H98O6 TZRLBGSETAVVDN-FCDMSKNPSA-N -BMDB63444 852.720690811 TG(16:1(9Z)/16:1(9Z)/20:3(8Z,11Z,14Z))[iso3] C55H96O6 YLSQMGKHEUFXMJ-LLQVRATESA-N -BMDB63445 886.798941124 TG(16:1(9Z)/16:1(9Z)/22:0)[iso3] C57H106O6 GOLXXQRKCMOJGT-KXSDLMDJSA-N -BMDB63446 884.783291069 TG(16:1(9Z)/16:1(9Z)/22:1(13Z))[iso3] C57H104O6 HJRVVCOWJQUKTM-ILPUFSCISA-N -BMDB63447 878.736340876 TG(16:1(9Z)/16:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso3] C57H98O6 ULPAJHKZIZPHLP-MLKQJLBNSA-N -BMDB63448 832.75199094 TG(16:1(9Z)/17:0/17:0)[iso3] C53H100O6 DSPFGQOCKPWWTL-NURROHNTSA-N -BMDB63449 846.767641004 TG(16:1(9Z)/17:0/18:0)[iso6] C54H102O6 VJOGKQKBWBCRFS-PLQIPONWSA-N -BMDB63450 844.75199094 TG(16:1(9Z)/17:0/18:1(9Z))[iso6] C54H100O6 IYMPJAZCIWGTJL-SADCDALBSA-N -BMDB63451 842.736340876 TG(16:1(9Z)/17:0/18:2(9Z,12Z))[iso6] C54H98O6 JZOHEVWPVBMMRQ-RCYQLFAGSA-N -BMDB63452 840.720690811 TG(16:1(9Z)/17:0/18:3(6Z,9Z,12Z))[iso6] C54H96O6 ZWZOQPNBFJCOLV-DWWGTDETSA-N -BMDB63453 840.720690811 TG(16:1(9Z)/17:0/18:3(9Z,12Z,15Z))[iso6] C54H96O6 UQVNCTOQWNCEKB-TZYGYGRMSA-N -BMDB63454 838.705040747 "TG(16:1(9Z)/17:0/18:4(6Z,9Z,12Z,15Z)) [iso6]" C54H94O6 RQWKOTDBFFRFCB-ZIUPLRSQSA-N -BMDB63455 870.767641004 TG(16:1(9Z)/17:0/20:2(11Z,14Z))[iso6] C56H102O6 UCRNOYAYVANCJQ-SYYSRGLNSA-N -BMDB63456 868.75199094 TG(16:1(9Z)/17:0/20:3(8Z,11Z,14Z))[iso6] C56H100O6 NYSVRQLIUIHBAY-FVHUFCPMSA-N -BMDB63457 866.736340876 TG(16:1(9Z)/17:0/20:4(5Z,8Z,11Z,14Z))[iso6] C56H98O6 YXSZUNCJXFSKTR-WZSPDGFKSA-N -BMDB63458 864.720690811 TG(16:1(9Z)/17:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C56H96O6 AKDVWAHETIXOFY-BGDHZSDESA-N -BMDB63459 892.75199094 TG(16:1(9Z)/17:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C58H100O6 JSIAWLQCIPHHEG-JATIUROSSA-N -BMDB63460 890.736340876 TG(16:1(9Z)/17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] C58H98O6 ALULOWZNTGURIV-ACORNCQLSA-N -BMDB63461 854.736340876 TG(16:1(9Z)/18:0/18:3(6Z,9Z,12Z))[iso6] C55H98O6 DJFHIFMJEYKBGL-GFUSBGQSSA-N -BMDB63462 854.736340876 TG(16:1(9Z)/18:0/18:3(9Z,12Z,15Z))[iso6] C55H98O6 GEKZYIPUAKKNKE-QIWFWJCZSA-N -BMDB63463 852.720690811 TG(16:1(9Z)/18:0/18:4(6Z,9Z,12Z,15Z))[iso6] C55H96O6 JLEMYYGTXQHVFE-GMMGLHSYSA-N -BMDB63464 884.783291069 TG(16:1(9Z)/18:0/20:2(11Z,14Z))[iso6] C57H104O6 WACLWOAQCVZQHO-ISJYKPTOSA-N -BMDB63465 882.767641004 TG(16:1(9Z)/18:0/20:3(8Z,11Z,14Z))[iso6] C57H102O6 WXMJAPVKXZKBEF-BRFSOIGOSA-N -BMDB63466 878.736340876 TG(16:1(9Z)/18:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C57H98O6 QRUQSCZKIVNCMK-ABLNOMLMSA-N -BMDB63467 906.767641004 TG(16:1(9Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z))[iso6] C59H102O6 BLQLNWGWKYGWQK-CLWLIQGKSA-N -BMDB63468 852.720690811 TG(16:1(9Z)/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C55H96O6 BTLLBFZSJPKPDE-QOAZIEKCSA-N -BMDB63469 852.720690811 TG(16:1(9Z)/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C55H96O6 CDPGTJRMESRMBM-YUXMUTLDSA-N -BMDB63470 882.767641004 TG(16:1(9Z)/18:1(9Z)/20:2(11Z,14Z))[iso6] C57H102O6 ONYOXARKNBCDOW-QLOILVOSSA-N -BMDB63471 880.75199094 TG(16:1(9Z)/18:1(9Z)/20:3(8Z,11Z,14Z))[iso6] C57H100O6 QXRVJZIWSZYNFE-PVWIZGPTSA-N -BMDB63472 906.767641004 TG(16:1(9Z)/18:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso6] C59H102O6 ZTSJYJYYBZBVKX-WXZPVFIASA-N -BMDB63473 870.767641004 TG(16:1(9Z)/18:2(9Z,12Z)/19:0)[iso6] C56H102O6 HJQWIRUYVPQAFR-PLBCZWSDSA-N -BMDB63474 880.75199094 TG(16:1(9Z)/18:2(9Z,12Z)/20:2(11Z,14Z))[iso6] C57H100O6 PASRUCZTFLIYBM-IJRUJQFPSA-N -BMDB63475 878.736340876 TG(16:1(9Z)/18:2(9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C57H98O6 FMRKXOSKBRKVCM-KKNBMUBZSA-N -BMDB63476 868.75199094 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/19:0)[iso6] C56H100O6 HFYCOLQPBBJXJA-NSQRKDLASA-N -BMDB63477 882.767641004 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/20:0)[iso6] C57H102O6 CDDMLDFHOOIDDR-IKVHAPJZSA-N -BMDB63478 880.75199094 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C57H100O6 WXMOURHYAWKCON-TWNFZGQVSA-N -BMDB63479 878.736340876 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/20:2(11Z,14Z))[iso6] C57H98O6 XZYPNCDNAQJUNT-IUKBTZBSSA-N -BMDB63480 868.75199094 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/19:0)[iso6] C56H100O6 SQAMASKSVQRATP-ULGKXKKNSA-N -BMDB63481 882.767641004 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:0)[iso6] C57H102O6 HLTSKBNGPCVUQB-GBISFHARSA-N -BMDB63482 880.75199094 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C57H100O6 ITVZPSFYQXIRPA-VOFAGOTGSA-N -BMDB63483 878.736340876 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C57H98O6 IQYIGUDLVCVSII-PCGFFDOBSA-N -BMDB63484 866.736340876 TG(16:1(9Z)/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C56H98O6 XMWDGKXOZBJHSI-APXDZQRCSA-N -BMDB63485 880.75199094 TG(16:1(9Z)/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C57H100O6 ZTNCEOWHIGXJAM-CAYPXVCWSA-N -BMDB63486 878.736340876 TG(16:1(9Z)/18:4(6Z,9Z,12Z,15Z)/20:1(11Z))[iso6] C57H98O6 UFZAMUNCCQBRIA-OYEDPGNGSA-N -BMDB63487 892.75199094 TG(16:1(9Z)/19:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H100O6 JCHWIDWIRCEUSB-HGOAQJBGSA-N -BMDB63488 906.767641004 TG(16:1(9Z)/20:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C59H102O6 MEAHLQMABQGZDE-FPIFSRQVSA-N -BMDB63489 906.767641004 TG(16:1(9Z)/20:2(11Z,14Z)/20:3(8Z,11Z,14Z))[iso6] C59H102O6 CLIHEBNFPBZHNL-XIAOPSCWSA-N -BMDB63490 858.767641004 TG(17:0/17:0/18:2(9Z,12Z))[iso3] C55H102O6 ZGSLFWOGQIOBFL-VVPOTBMCSA-N -BMDB63491 856.75199094 TG(17:0/17:0/18:3(6Z,9Z,12Z))[iso3] C55H100O6 VRPYQTOQXLDFMX-SPTFLQPBSA-N -BMDB63492 856.75199094 TG(17:0/17:0/18:3(9Z,12Z,15Z))[iso3] C55H100O6 NKZUGKBNYDSITN-VDZWBLLGSA-N -BMDB63493 854.736340876 TG(17:0/17:0/18:4(6Z,9Z,12Z,15Z))[iso3] C55H98O6 YTTQBWQDYUFCSA-NAFCWSLPSA-N -BMDB63494 886.798941133 TG(17:0/17:0/20:2(11Z,14Z))[iso3] C57H106O6 YTVHAAFNMKPYPC-KJFPCCCASA-N -BMDB63495 884.783291069 TG(17:0/17:0/20:3(8Z,11Z,14Z))[iso3] C57H104O6 YNILOPAJJGLMFA-DNQJGVSOSA-N -BMDB63496 882.767641004 TG(17:0/17:0/20:4(5Z,8Z,11Z,14Z))[iso3] C57H102O6 HFMQRBDGAXXEPX-CBJYRBMGSA-N -BMDB63497 880.75199094 TG(17:0/17:0/20:5(5Z,8Z,11Z,14Z,17Z))[iso3] C57H100O6 CZNAEULIOKMPIT-KLHJYXIRSA-N -BMDB63498 906.767641004 TG(17:0/17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3] C59H102O6 VUUDLKGZZONILP-LKHIMEMDSA-N -BMDB63499 870.767641004 TG(17:0/18:0/18:3(6Z,9Z,12Z))[iso6] C56H102O6 XGSYVNUYOAPADT-FPTDWALLSA-N -BMDB63500 870.767641004 TG(17:0/18:0/18:3(9Z,12Z,15Z))[iso6] C56H102O6 FHGCKCMUAGEPBN-VZHYTBPDSA-N -BMDB63501 868.75199094 TG(17:0/18:0/18:4(6Z,9Z,12Z,15Z))[iso6] C56H100O6 WHQHLXXVJFGIHA-FOWMKEALSA-N -BMDB63502 870.767641004 TG(17:0/18:1(9Z)/18:2(9Z,12Z))[iso6] C56H102O6 NIBMDPFMDDQNNX-ZIZOGWBTSA-N -BMDB63503 868.75199094 TG(17:0/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C56H100O6 WGTFIXDSYLYPIO-BGZYNWNKSA-N -BMDB63504 868.75199094 TG(17:0/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C56H100O6 RLDKFJHHHPZZSZ-OQLDQSHXSA-N -BMDB63505 866.736340876 TG(17:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z))[iso6] C56H98O6 PMGHPLURWDJYIA-RJGAYMEZSA-N -BMDB63506 892.75199094 TG(17:0/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H100O6 IZABRXOLKZSJQE-FSXITCNNSA-N -BMDB63507 868.75199094 TG(17:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3] C56H100O6 KDMIHSMAUYYFRT-CVUWVRRUSA-N -BMDB63508 866.736340876 TG(17:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z))[iso6] C56H98O6 DFXCMORZVKLRKD-YAVDIEDFSA-N -BMDB63509 866.736340876 TG(17:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C56H98O6 YKYBJYBGJSSOPS-BAIMUXHHSA-N -BMDB63510 864.720690811 TG(17:0/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z))[iso6] C56H96O6 QYXDPUCJKHASSS-QTXXCDAOSA-N -BMDB63511 886.798941133 TG(17:0/18:2(9Z,12Z)/19:0)[iso6] C57H106O6 ODVIBCXVHRRTPD-IEHWOXSQSA-N -BMDB63512 892.75199094 TG(17:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H100O6 BXAPIWIPIAIOFJ-GLSIKBKESA-N -BMDB63513 890.736340876 TG(17:0/18:2(9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H98O6 ROGWRURLPSZEGG-VPCCGMSKSA-N -BMDB63514 864.720690811 TG(17:0/18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z))[iso3] C56H96O6 PGKDOVRUFMWBJF-PFRCZTMUSA-N -BMDB63515 864.720690811 TG(17:0/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C56H96O6 CKBRAQLYLBQRIX-AONJIWAKSA-N -BMDB63516 884.783291069 TG(17:0/18:3(6Z,9Z,12Z)/19:0)[iso6] C57H104O6 ZPZYLUILMNHVJP-IKGQCQCDSA-N -BMDB63517 892.75199094 TG(17:0/18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C58H100O6 SQYGFAHCJUUPQR-OVOORJLESA-N -BMDB63518 890.736340876 TG(17:0/18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H98O6 DLPMNSVMPLSBDG-FHRCQLBLSA-N -BMDB63519 888.720690811 TG(17:0/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H96O6 LSJAABCNVHPDCI-MJOXPQNPSA-N -BMDB63520 864.720690811 TG(17:0/18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))[iso3] C56H96O6 IYGOQYAYRRPIQZ-HWVCCPOJSA-N -BMDB63521 884.783291069 TG(17:0/18:3(9Z,12Z,15Z)/19:0)[iso6] C57H104O6 MPTJQWHQNGQSMW-DXRFALFFSA-N -BMDB63522 892.75199094 TG(17:0/18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z))[iso6] C58H100O6 LEMUJBJDTUDJMD-GTHCODMRSA-N -BMDB63523 890.736340876 TG(17:0/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H98O6 YRLWGWBRSRAFBX-SKTBQBPLSA-N -BMDB63524 888.720690811 TG(17:0/18:3(9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H96O6 OWYKVBJUHHPYNY-FJNLLGRXSA-N -BMDB63525 882.767641004 TG(17:0/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C57H102O6 FPVCQWQOFRSFDA-VRQFSDKGSA-N -BMDB63526 892.75199094 TG(17:0/18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C58H100O6 RUIGDQLAZOLYQB-JZCNPKAMSA-N -BMDB63527 890.736340876 TG(17:0/18:4(6Z,9Z,12Z,15Z)/20:3(8Z,11Z,14Z))[iso6] C58H98O6 HIKCIZUSEJHKHD-WIJABWIISA-N -BMDB63528 888.720690811 TG(17:0/18:4(6Z,9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z))[iso6] C58H96O6 OOKGPTVMPAIFEM-LHLIHLHHSA-N -BMDB63529 886.705040747 TG(17:0/18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C58H94O6 JQODABMELXPSIL-GKTKKIEXSA-N -BMDB63530 884.783291069 TG(18:0/18:0/18:3(6Z,9Z,12Z))[iso3] C57H104O6 KQKXUUFGXDXTLP-JSNAXDNMSA-N -BMDB63531 884.783291069 TG(18:0/18:0/18:3(9Z,12Z,15Z))[iso3] C57H104O6 UFGXGACWXCNPJD-HRISYRPYSA-N -BMDB63532 882.767641004 TG(18:0/18:0/18:4(6Z,9Z,12Z,15Z))[iso3] C57H102O6 QDQDETHJEUGTEX-WOYOQTORSA-N -BMDB63533 882.767641004 TG(18:0/18:1(9Z)/18:3(6Z,9Z,12Z))[iso6] C57H102O6 JOJVDNJANFYSHZ-DBCJGJTESA-N -BMDB63534 882.767641004 TG(18:0/18:1(9Z)/18:3(9Z,12Z,15Z))[iso6] C57H102O6 BRLGHZXETDWABO-NOFIOOQLSA-N -BMDB63535 880.75199094 TG(18:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z))[iso6] C57H100O6 IXDYCTWELIBSSO-MYNDMTSSSA-N -BMDB63536 906.767641004 TG(18:0/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))[iso6] C59H102O6 BLNSKVFNUJRUQY-WNXRKLEXSA-N -BMDB63537 880.75199094 TG(18:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z))[iso6] C57H100O6 FOOVNYMOCOZYCS-XZXQMJNPSA-N -BMDB63538 880.75199094 TG(18:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C57H100O6 CFIAQJQGPHURGU-FFRWHZMHSA-N -BMDB63539 878.736340876 TG(18:0/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z))[iso6] C57H98O6 DQBBVSOYDVFHHR-ALECUMLNSA-N -BMDB63540 878.736340876 TG(18:0/18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z))[iso3] C57H98O6 YFSUXBREMFQRTA-RCTPIDLSSA-N -BMDB63541 878.736340876 TG(18:0/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C57H98O6 NSVZZMLKVNWYJQ-RTBIBGFGSA-N -BMDB63542 906.767641004 TG(18:0/18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C59H102O6 DTZRWGXUFSGPFR-MAQKVQBLSA-N -BMDB63543 878.736340876 TG(18:0/18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))[iso3] C57H98O6 DKDIPDJHNARQPL-VVBSAFLRSA-N -BMDB63544 906.767641004 TG(18:0/18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z))[iso6] C59H102O6 BLUDAFKQGMJGEC-NGLAXFQYSA-N -BMDB63545 906.767641004 TG(18:0/18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C59H102O6 NXJJDBZGHIYKEZ-HPNWPOBHSA-N -BMDB63546 880.751990932 TG(18:1(9Z)/18:1(9Z)/18:3(6Z,9Z,12Z))[iso3] C57H100O6 GOEUQPTVSLNGLY-SIPJYBKGSA-N -BMDB63547 878.736340876 TG(18:1(9Z)/18:1(9Z)/18:4(6Z,9Z,12Z,15Z))[iso3] C57H98O6 LXSVMCLLFGNHGU-TXMXRHPOSA-N -BMDB63548 878.736340876 TG(18:1(9Z)/18:2(9Z,12Z)/18:3(6Z,9Z,12Z))[iso6] C57H98O6 IXLZJCDOWKHYDW-ZSOPFFCFSA-N -BMDB63549 878.736340876 TG(18:1(9Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))[iso6] C57H98O6 OTUIORVXGJUHBH-QVHNWUKDSA-N -BMDB63550 906.767641004 TG(18:1(9Z)/18:2(9Z,12Z)/20:3(8Z,11Z,14Z))[iso6] C59H102O6 QVHPQMFZIADWSB-DUXSNVJQSA-N -BMDB63551 906.767641004 TG(18:1(9Z)/18:3(6Z,9Z,12Z)/20:2(11Z,14Z))[iso6] C59H102O6 AQAMVFXGOIAPNB-QGGAJVRASA-N -BMDB63552 906.767641004 TG(18:1(9Z)/18:3(9Z,12Z,15Z)/20:2(11Z,14Z))[iso6] C59H102O6 XKXXQSRUTFKWEA-XBYCHKDGSA-N -BMDB63553 906.767641004 TG(18:1(9Z)/18:4(6Z,9Z,12Z,15Z)/20:1(11Z))[iso6] C59H102O6 NEZJLYSHWRBTKF-SHZXWNAJSA-N -BMDB63554 906.767641004 TG(18:2(9Z,12Z)/18:3(6Z,9Z,12Z)/20:1(11Z))[iso6] C59H102O6 PYHHMOTVUBGCGU-KDBYXRCCSA-N -BMDB63555 906.767641004 TG(18:2(9Z,12Z)/18:3(9Z,12Z,15Z)/20:1(11Z))[iso6] C59H102O6 OPAZFAIACILRAX-LYHHFUMBSA-N -BMDB63556 892.75199094 TG(18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C58H100O6 IWSIQFSLWTWZBM-IBAUZGQOSA-N -BMDB63557 906.767641004 TG(18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/20:0)[iso6] C59H102O6 OUDDBCROTIJNID-HESJFKEISA-N -BMDB63558 892.75199094 TG(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)/19:0)[iso3] C58H100O6 SHFNNWWHRVJQLJ-RRTHCMCYSA-N -BMDB63559 906.767641004 TG(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)/20:0)[iso3] C59H102O6 WTJCHFNBXDEBKO-SHJQGDKGSA-N -BMDB63560 892.75199094 TG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/19:0)[iso6] C58H100O6 NUGPJMHUHWYFBO-HAVTXTANSA-N -BMDB63561 906.767641004 TG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/20:0)[iso6] C59H102O6 FTCKBISNHQAXOS-XQWGTCMGSA-N -BMDB63562 890.736340876 TG(18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C58H98O6 NIQMENRTBFBVFB-YZTHFXLSSA-N -BMDB63563 892.75199094 TG(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)/19:0)[iso3] C58H100O6 KBAPIIQCFAUULH-OTKJKKTOSA-N -BMDB63564 906.767641004 TG(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)/20:0)[iso3] C59H102O6 JAWLPRKTMXIDRD-VBJGMMQBSA-N -BMDB63565 890.736340876 TG(18:3(9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)/19:0)[iso6] C58H98O6 OOGDYJZDYDFBBH-HRQMDNMZSA-N -BMDB63566 888.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)/19:0)[iso3] C58H96O6 PDSFPTSIGNJEQL-CEIJWCSWSA-N -BMDB63567 728.583225334 "SM(d18:0/18:2(9Z,12Z)) " C41H81N2O6P LOHIJJRFCAEEGY-QPYJHBIRSA-N -BMDB63568 828.708425849 "SM(d19:0/24:1(15Z)) " C48H97N2O6P LXMARZYBSFYVSY-KUQVZNNZSA-N -BMDB63569 814.692775294 "SM(d18:0/24:1(15Z)) " C47H95N2O6P XZBDYCJQWJNNJB-CFLZVKAOSA-N -BMDB63570 842.724075914 "SM(d20:0/24:1(15Z)) " C49H99N2O6P JWKOQODXKXAOQW-ALKNTWKZSA-N -BMDB63571 240.208930142 "10Z-Pentadecenoic acid" C15H28O2 APXSAEQXOXTDAM-WAYWQWQTSA-N -BMDB63572 282.255880332 "6E-Octadecenoic acid" C18H34O2 CNVZJPUDSLNTQU-OUKQBFOZSA-N -BMDB63573 282.255880332 "7E-Octadecenoic acid" C18H34O2 RVUCYJXFCAVHNC-VAWYXSNFSA-N -BMDB63574 282.255880335 "trans-8-Elaidic acid" C18H34O2 WRIDQFICGBMAFQ-ZHACJKMWSA-N -BMDB63575 282.255880332 "9E-Octadecenoic acid" C18H34O2 ZQPPMHVWECSIRJ-MDZDMXLPSA-N -BMDB63576 282.255880332 "10E-Octadecenoic acid" C18H34O2 QXJSBBXBKPUZAA-CMDGGOBGSA-N -BMDB63577 282.255880335 "trans-12-Elaidic acid" C18H34O2 OXEDXHIBHVMDST-VOTSOKGWSA-N -BMDB63578 336.302830528 "5Z,13Z-Docosadienoic acid" C22H40O2 ILJOFPXBYTXXCP-PWTUJKELSA-N -BMDB63579 328.240230268 "4Z,7Z,10Z,13Z,16Z,19Z-Docosahexaenoic acid" C22H32O2 MBMBGCFOFBJSGT-KUBAVDMBSA-N -BMDB63580 688.551925205 SM(16:1(11E)/17:0) C38H77N2O6P NFKIRSWGHHRNCC-FQCGQDBESA-N -BMDB63581 702.56757527 SM(16:1(11E)/18:0) C39H79N2O6P SHHZAYWGLRSCPR-CTJXKQIDSA-N -BMDB63582 700.551925205 SM(16:1(11E)/18:1(11E)) C39H77N2O6P OLTDDQQBTMKIJV-XNYODWHASA-N -BMDB63583 716.583225334 SM(16:1(11E)/19:0) C40H81N2O6P SEWCPYNJRIBRDH-ACOKGBTCSA-N -BMDB63584 730.598875399 SM(16:1(11E)/20:0) C41H83N2O6P LYUBDOFTFDCHCS-FVSABMTJSA-N -BMDB63585 728.583225334 SM(18:1(11E)/18:1(9E)) C41H81N2O6P PDJBDVPBAZFKPT-PRCCPDMFSA-N -BMDB63586 758.630175527 SM(18:1(11E)/20:0) C43H87N2O6P KFYASDPSVLPJFZ-RLUGYQEDSA-N -BMDB63588 772.645825592 SM(18:1(11E)/21:0) C44H89N2O6P ZZOWDUOKDXULKW-MQDRILMCSA-N -BMDB63589 786.661475656 SM(18:1(11E)/22:0) C45H91N2O6P YWTQZDQCLLJJMO-SKACQKSKSA-N -BMDB63590 784.645825592 SM(18:2(9E,12E)/22:0) C45H89N2O6P KNKHTTBVLRIQFG-URMKVRBYSA-N -BMDB63591 800.677125721 SM(17:1(10E)/24:0) C46H93N2O6P WDCZPNUFGZODRI-NELHSPAMSA-N -BMDB63592 798.661475656 SM(18:2(9E,12E)/23:0) C46H91N2O6P ZRKFXRCPPWXSJE-ADZKJEMBSA-N -BMDB63593 814.692775785 SM(18:1(11E)/24:0) C47H95N2O6P PYLWNJICBMYPHE-LCHFQSLOSA-N -BMDB63594 842.724075914 SM(18:2(9E,12E)/24:0) C49H99N2O6P AJTHGVHRBBWIEP-FVNSHYMDSA-N -BMDB63595 828.708425849 SM(19:0/24:1(15Z)) C48H97N2O6P LXMARZYBSFYVSY-KUQVZNNZSA-N -BMDB63596 842.724075914 SM(20:0/24:1(15Z)) C49H99N2O6P JWKOQODXKXAOQW-ALKNTWKZSA-N -BMDB63598 602.527410734 DG(O-16:0/20:4(8E,11E,14E,17E)) C39H70O4 ZOQPRIBCWWPWEH-LGUDIITJSA-N -BMDB63599 730.647525862 DG(24:0/20:3(8Z,11Z,14Z) C47H86O5 VOJMKRSTEQMACO-SNGWNOJZSA-N -BMDB63600 170.021523293 "gallic acid" C7H6O5 LNTHITQWFMADLM-UHFFFAOYSA-N -BMDB63601 361.8757165 Aldrin C12H8Cl6 QBYJBZPUGVGKQQ-SJJAEHHWSA-N -BMDB63602 287.8600664 alpha-Hexachlorocyclohexane(HCH) C6H6Cl6 JLYXXMFPNIAWKQ-LKPKBOIGSA-N -BMDB63604 215.09377318 "atrazine " C8H14ClN5 MXWJVTOOROXGIU-UHFFFAOYSA-N -BMDB63605 287.860066434 beta-Hexachlorocyclohexane(HCH) C6H6Cl6 JLYXXMFPNIAWKQ-CDRYSYESSA-N -BMDB63606 287.860066434 delta-Hexachlorocyclohexane C6H6Cl6 JLYXXMFPNIAWKQ-GPIVLXJGSA-N -BMDB63609 287.860066434 gamma-Hexachlorocyclohexane(HCH) C6H6Cl6 JLYXXMFPNIAWKQ-GNIYUCBRSA-N -BMDB63610 317.953661148 "o,p′-DDD" C14H10Cl4 JWBOIMRXGHLCPP-UHFFFAOYSA-N -BMDB63611 315.9380111 "o,p′-DDE" C14H8Cl4 ZDYJWDIWLRZXDB-UHFFFAOYSA-N -BMDB63612 351.914688823 "o,p′-DDT" C14H9Cl5 CVUGPAFCQJIYDT-UHFFFAOYSA-N -BMDB63613 261.063722467 "Oxolinic Acid " C13H11NO5 KYGZCKSPAKDVKC-UHFFFAOYSA-N -BMDB63614 317.953661148 "p,p′-DDD" C14H10Cl4 AHJKRLASYNVKDZ-UHFFFAOYSA-N -BMDB63615 315.938011084 "p,p′-DDE" C14H8Cl4 UCNVFOCBFJOQAL-UHFFFAOYSA-N -BMDB63616 351.914688823 "p,p′-DDT" C14H9Cl5 YVGGHNCTFXOJCH-UHFFFAOYSA-N -BMDB63619 403.8168814 beta-endosulfan C9H6Cl6O3S RDYMFSUJUZBWLH-FYHLGZKHSA-N -BMDB63620 403.8168814 alpha-endosulfan C9H6Cl6O3S RDYMFSUJUZBWLH-AMHWMVONSA-N -BMDB63621 537.512095021 Cer(d18:0/16:1(11Z)) C34H67NO3 CNOVLYHRDNYVLT-DIBQBJQOSA-N -BMDB63622 593.574695279 Cer(d18:0/20:1(11Z)) C38H75NO3 PULBITQLTXYVQX-FMECKOKGSA-N -BMDB63623 635.621645472 Cer(d17:0/24:1(15Z)) C41H81NO3 ILZGEVUWFUWJOI-QVEKJMDDSA-N -BMDB63624 647.621645472 Cer(d20:0/22:2(6Z,13Z)) C42H81NO3 ABZIJOKCYYZWFJ-LHRBHQDFSA-N -BMDB63625 152.047344122 "3-Cresotinic acid" C8H8O3 WHSXTWFYRGOBGO-UHFFFAOYSA-N -BMDB63626 188.116092388 Glycyl-Isoleucine C8H16N2O3 KGVHCTWYMPWEGN-UHFFFAOYSA-N -BMDB63627 226.106590334 Histidinyl-Alanine C9H14N4O3 FRJIAZKQGSCKPQ-UHFFFAOYSA-N -BMDB63628 207.125928791 Phenyl-Leucine C12H17NO2 GUKOKXKMWGOHJJ-NSHDSACASA-N -BMDB63629 238.095356946 Tyrosyl-Glycine C11H14N2O4 HPYDSVWYXXKHRD-UHFFFAOYSA-N -BMDB63630 925.749956311 PC(24:0/22:2(6Z,13Z)) C54H104NO8P QYVKBNMHUYGIRK-IHXGGWPCSA-N -BMDB63631 877.692441433 PC(O-22:0/22:5(7Z,10Z,13Z,16Z,19Z)) C52H96NO7P VNNPAAOAYXMMKU-JCWXPRBNSA-N -BMDB63632 240.089022153 Cyanazine C9H13ClN6 MZZBPDKVEFVLFF-UHFFFAOYSA-N -BMDB63633 241.136116323 Prometryn C10H19N5S AAEVYOVXGOFMJO-UHFFFAOYSA-N -BMDB63634 201.078123116 Simazine C7H12ClN5 ODCWYMIRDDJXKW-UHFFFAOYSA-N -BMDB63635 241.136116323 Terbutryn C10H19N5S IROINLKCQGIITA-UHFFFAOYSA-N
--- a/test-data/out05.tabular Tue Jan 21 16:09:45 2020 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,6737 +0,0 @@ -HMDB_ID MzBank MetName ChemFormula INChIkey -HMDB0000001 169.085126611 1-Methylhistidine C7H11N3O2 BRMWTNUJHUMWMS-LURJTMIESA-N -HMDB0000002 74.08439833 1,3-Diaminopropane C3H10N2 XFNJVJPLKCPIBV-UHFFFAOYSA-N -HMDB0000008 104.047344122 "2-Hydroxybutyric acid" C4H8O3 AFENDNXGAFYKQO-UHFFFAOYSA-N -HMDB0000012 228.074621504 Deoxyuridine C9H12N2O5 MXHRCPNRJAMMIM-SHYZEUOFSA-N -HMDB0000014 227.090605919 Deoxycytidine C9H13N3O4 CKTSBUTUHBMZGZ-SHYZEUOFSA-N -HMDB0000015 346.214409448 Cortexolone C21H30O4 WHBHBVVOGNECLV-OBQKJFGGSA-N -HMDB0000017 183.053157781 "4-Pyridoxic acid" C8H9NO4 HXACOUQIXZGNBF-UHFFFAOYSA-N -HMDB0000019 116.047344122 "alpha-Ketoisovaleric acid" C5H8O3 QHKABHOOEWYVLI-UHFFFAOYSA-N -HMDB0000020 152.047344122 "p-Hydroxyphenylacetic acid" C8H8O3 XQXPVVBIMDBYFF-UHFFFAOYSA-N -HMDB0000023 104.047344122 "(S)-3-Hydroxyisobutyric acid" C4H8O3 DBXBTMSZEOQQDU-VKHMYHEASA-N -HMDB0000026 132.053492132 "Ureidopropionic acid" C4H8N2O3 JSJWCHRYRHKBBW-UHFFFAOYSA-N -HMDB0000027 241.117489371 Tetrahydrobiopterin C9H15N5O3 FNKQXYHWGSIFBK-UHFFFAOYSA-N -HMDB0000030 244.088163078 Biotin C10H16N2O3S YBJHBAHKTGYVGT-ZKWXMUAHSA-N -HMDB0000033 226.106590334 Carnosine C9H14N4O3 CQOVPNPJLQNMDC-ZETCQYMHSA-N -HMDB0000034 135.054495185 Adenine C5H5N5 GFFGJBXGBJISGV-UHFFFAOYSA-N -HMDB0000036 515.291673489 "Taurocholic acid" C26H45NO7S WBWWGRHZICKQGZ-HZAMXZRMSA-N -HMDB0000038 239.101839307 Dihydrobiopterin C9H13N5O3 FEMXZDUTFRTWPE-UHFFFAOYSA-N -HMDB0000039 88.0524295 "Butyric acid" C4H8O2 FERIUCNNQQJTOY-UHFFFAOYSA-N -HMDB0000042 60.021129372 "Acetic acid" C2H4O2 QTBSBXVTEAMEQO-UHFFFAOYSA-N -HMDB0000043 117.078978601 Betaine C5H11NO2 KWIUHFFTVRNATP-UHFFFAOYSA-N -HMDB0000045 347.063084339 "Adenosine monophosphate" C10H14N5O7P UDMBCSSLTHHNCD-KQYNXXCUSA-N -HMDB0000050 267.096753929 Adenosine C10H13N5O4 OIRDTQYFTABQOQ-KQYNXXCUSA-N -HMDB0000054 584.263484904 Bilirubin C33H36N4O6 BPYKTIZUTYGOLE-IFADSCNNSA-N -HMDB0000056 89.047678473 beta-Alanine C3H7NO2 UCMIRNVEIXFBKS-UHFFFAOYSA-N -HMDB0000058 329.052519653 "Cyclic AMP" C10H12N5O6P IVOMOUWHDPKRLL-KQYNXXCUSA-N -HMDB0000060 102.031694058 "Acetoacetic acid" C4H6O3 WDJHALXBUFZDSR-UHFFFAOYSA-N -HMDB0000062 161.105193351 L-Carnitine C7H15NO3 PHIQHXFUZVPYII-ZCFIWIBFSA-N -HMDB0000064 131.069476547 Creatine C4H9N3O2 CVSVTCORWBXHQV-UHFFFAOYSA-N -HMDB0000067 386.354866094 Cholesterol C27H46O HVYWMOMLDIMFJA-DPAQBDIFSA-N -HMDB0000070 129.078978601 "Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-UHFFFAOYSA-N -HMDB0000071 252.085854882 Deoxyinosine C10H12N4O4 VGONTNSXDCQUGY-RRKCRQDMSA-N -HMDB0000073 153.078978601 Dopamine C8H11NO2 VYFYYTLLBUKUHU-UHFFFAOYSA-N -HMDB0000076 114.042927446 Dihydrouracil C4H6N2O2 OIVLITBTBDPEFK-UHFFFAOYSA-N -HMDB0000085 267.096753929 Deoxyguanosine C10H13N5O4 YKBGVTZYEHREMT-KVQBGUIXSA-N -HMDB0000086 257.102823889 Glycerophosphocholine C8H20NO6P SUHOQUVVVLNYQR-QMMMGPOBSA-N -HMDB0000087 45.057849229 Dimethylamine C2H7N ROSDSFDQCJNGOL-UHFFFAOYSA-N -HMDB0000089 243.085520541 Cytidine C9H13N3O5 UHDGCWIWMRVCDJ-XVFCMESISA-N -HMDB0000092 103.063328537 Dimethylglycine C4H9NO2 FFDGPVCHZBVARC-UHFFFAOYSA-N -HMDB0000094 192.02700261 "Citric acid" C6H8O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N -HMDB0000095 323.051850951 "Cytidine monophosphate" C9H14N3O8P IERHLVCPSMICTF-XVFCMESISA-N -HMDB0000097 104.107539075 Choline C5H14NO OEYIOHPDSNJKLS-UHFFFAOYSA-N -HMDB0000098 150.05282343 D-Xylose C5H10O5 SRBFZHDQGSBBOR-IOVATXLUSA-N -HMDB0000099 222.067427636 L-Cystathionine C7H14N2O4S ILRYLPWNYFXEMH-WHFBIAKZSA-N -HMDB0000101 251.101839307 Deoxyadenosine C10H13N5O3 OLXZPDWKRNYJJZ-RRKCRQDMSA-N -HMDB0000107 182.07903818 Galactitol C6H14O6 FBPFZTCFMRRESA-GUCUJZIJSA-N -HMDB0000108 46.041864814 Ethanol C2H6O LFQSCWFLJHTTHZ-UHFFFAOYSA-N -HMDB0000112 103.063328537 "gamma-Aminobutyric acid" C4H9NO2 BTCSSZJGUNDROE-UHFFFAOYSA-N -HMDB0000114 215.055873697 Glycerylphosphorylethanolamine C5H14NO6P FRMZOWIQVCBEAC-UHFFFAOYSA-N -HMDB0000115 76.016043994 "Glycolic acid" C2H4O3 AEMRFAOFKBGASW-UHFFFAOYSA-N -HMDB0000118 182.057908808 "Homovanillic acid" C9H10O4 QRMZSPFSDQBLIX-UHFFFAOYSA-N -HMDB0000119 74.00039393 "Glyoxylic acid" C2H2O3 HHLFWLYXYJOTON-UHFFFAOYSA-N -HMDB0000121 441.139681375 "Folic acid" C19H19N7O6 OVBPIULPVIDEAO-LBPRGKRZSA-N -HMDB0000122 180.063388116 D-Glucose C6H12O6 WQZGKKKJIJFFOK-GASJEMHNSA-N -HMDB0000123 75.032028409 Glycine C2H5NO2 DHMQDGOQFOQNFH-UHFFFAOYSA-N -HMDB0000126 172.013674532 "Glycerol 3-phosphate" C3H9O6P AWUCVROLDVIAJX-GSVOUGTGSA-N -HMDB0000127 194.042652674 "D-Glucuronic acid" C6H10O7 AEMOLEFTQBMNLQ-WAXACMCWSA-N -HMDB0000128 117.053826483 "Guanidoacetic acid" C3H7N3O2 BPMFZUMJYQTVII-UHFFFAOYSA-N -HMDB0000130 168.042258744 "Homogentisic acid" C8H8O4 IGMNYECMUMZDDF-UHFFFAOYSA-N -HMDB0000131 92.047344122 Glycerol C3H8O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N -HMDB0000132 151.049409807 Guanine C5H5N5O UYTPUPDQBNUYGX-UHFFFAOYSA-N -HMDB0000133 283.091668551 Guanosine C10H13N5O5 NYHBQMYGNKIUIF-UUOKFMHZSA-N -HMDB0000134 116.010958616 "Fumaric acid" C4H4O4 VZCYOOQTPOCHFL-OWOJBTEDSA-N -HMDB0000138 465.309038113 "Glycocholic acid" C26H43NO6 RFDAIACWWDREDC-MZMBZMQMSA-N -HMDB0000139 106.02660868 "Glyceric acid" C3H6O4 RBNPOMFGQQGHHO-UWTATZPHSA-N -HMDB0000142 46.005479308 "Formic acid" CH2O2 BDAGIHXWWSANSR-UHFFFAOYSA-N -HMDB0000143 180.063388116 D-Galactose C6H12O6 WQZGKKKJIJFFOK-PHYPRBDBSA-N -HMDB0000148 147.053157781 "L-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-VKHMYHEASA-N -HMDB0000149 61.052763851 Ethanolamine C2H7NO HZAXFHJVJLSVMW-UHFFFAOYSA-N -HMDB0000152 154.026608673 "Gentisic acid" C7H6O4 WXTMDXOMEHJXQO-UHFFFAOYSA-N -HMDB0000156 134.021523302 "L-Malic acid" C4H6O5 BJEPYKJPYRNKOW-REOHCLBHSA-N -HMDB0000157 136.03851077 Hypoxanthine C5H4N4O FDGQSTZJBFJUBT-UHFFFAOYSA-N -HMDB0000158 181.073893223 L-Tyrosine C9H11NO3 OUYCCCASQSFEME-QMMMGPOBSA-N -HMDB0000159 165.078978601 L-Phenylalanine C9H11NO2 COLNVLDHVKWLRT-QMMMGPOBSA-N -HMDB0000161 89.047678473 L-Alanine C3H7NO2 QNAYBMKLOCPYGJ-REOHCLBHSA-N -HMDB0000162 115.063328537 L-Proline C5H9NO2 ONIBWKKTOPOVIA-BYPYZUCNSA-N -HMDB0000163 342.116211546 D-Maltose C12H22O11 GUBGYTABKSRVRQ-DKBJLJRDSA-N -HMDB0000164 31.042199165 Methylamine CH5N BAVYZALUXZFZLV-UHFFFAOYSA-N -HMDB0000167 119.058243159 L-Threonine C4H9NO3 AYFVYJQAPQTCCC-GBXIJSLDSA-N -HMDB0000168 132.053492132 L-Asparagine C4H8N2O3 DCXYFEDJOCDNAF-REOHCLBHSA-N -HMDB0000169 180.063388116 D-Mannose C6H12O6 WQZGKKKJIJFFOK-QTVWNMPRSA-N -HMDB0000172 131.094628665 L-Isoleucine C6H13NO2 AGPKZVBTJJNPAG-WHFBIAKZSA-N -HMDB0000174 164.068473494 L-Fucose C6H12O5 SHZGCJCMOBCMKK-DHVFOXMCSA-N -HMDB0000175 348.047099924 "Inosinic acid" C10H13N4O8P GRSZFWQUAKGDAV-KQYNXXCUSA-N -HMDB0000176 116.010958616 "Maleic acid" C4H4O4 VZCYOOQTPOCHFL-UPHRSURJSA-N -HMDB0000177 155.069476547 L-Histidine C6H9N3O2 HNDVDQJCIGZPNO-YFKPBYRVSA-N -HMDB0000182 146.105527702 L-Lysine C6H14N2O2 KDXKERNSBIXSRK-YFKPBYRVSA-N -HMDB0000186 342.116211546 Alpha-Lactose C12H22O11 GUBGYTABKSRVRQ-XLOQQCSPSA-N -HMDB0000187 105.042593095 L-Serine C3H7NO3 MTCFGRXMJLQNBG-REOHCLBHSA-N -HMDB0000190 90.031694058 "L-Lactic acid" C3H6O3 JVTAAEKCZFNVCJ-REOHCLBHSA-N -HMDB0000191 133.037507717 "L-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-REOHCLBHSA-N -HMDB0000192 240.023848262 L-Cystine C6H12N2O4S2 LEVWYRKDKASIDU-IMJSIDKUSA-N -HMDB0000194 240.122240398 Anserine C10H16N4O3 MYYIAHXIVFADCU-QMMMGPOBSA-N -HMDB0000195 268.080769514 Inosine C10H12N4O5 UGQMRVRMYYASKQ-KQYNXXCUSA-N -HMDB0000197 175.063328537 "Indoleacetic acid" C10H9NO2 SEOVTRFCIGRIMH-UHFFFAOYSA-N -HMDB0000201 203.115758031 L-Acetylcarnitine C9H17NO4 RDHQFKQIGNGIED-MRVPVSSYSA-N -HMDB0000202 118.02660868 "Methylmalonic acid" C4H6O4 ZIYVHBGGAOATLY-UHFFFAOYSA-N -HMDB0000205 164.047344122 "Phenylpyruvic acid" C9H8O3 BTNMPGBKDVTSJY-UHFFFAOYSA-N -HMDB0000206 188.116092388 N6-Acetyl-L-lysine C8H16N2O3 DTERQYGMUDWYAZ-ZETCQYMHSA-N -HMDB0000207 282.255880332 "Oleic acid" C18H34O2 ZQPPMHVWECSIRJ-KTKRTIGZSA-N -HMDB0000208 146.021523302 "Oxoglutaric acid" C5H6O5 KPGXRSRHYNQIFN-UHFFFAOYSA-N -HMDB0000209 136.0524295 "Phenylacetic acid" C8H8O2 WLJVXDMOQOGPHL-UHFFFAOYSA-N -HMDB0000210 219.110672659 "Pantothenic acid" C9H17NO5 GHOKWGTUZJEAQD-ZETCQYMHSA-N -HMDB0000211 180.063388116 myo-Inositol C6H12O6 CDAISMWEOUEBRE-GPIVLXJGSA-N -HMDB0000212 221.089937217 N-Acetylgalactosamine C8H15NO6 OVRNDRQMDRJTHS-CBQIKETKSA-N -HMDB0000213 260.029718526 "Myo-inositol 1-phosphate" C6H13O9P INAPMGSXUVUWAF-PTQMNWPWSA-N -HMDB0000214 132.089877638 Ornithine C5H12N2O2 AHLPHDHHMVZTML-BYPYZUCNSA-N -HMDB0000215 221.089937217 N-Acetyl-D-glucosamine C8H15NO6 OVRNDRQMDRJTHS-RTRLPJTCSA-N -HMDB0000220 256.240230268 "Palmitic acid" C16H32O2 IPCSVZSSVZVIGE-UHFFFAOYSA-N -HMDB0000222 399.334858933 L-Palmitoylcarnitine C23H45NO4 XOMRRQXKHMYMOC-OAQYLSRUSA-N -HMDB0000224 141.019094261 O-Phosphoethanolamine C2H8NO4P SUHOOTKUPISOBE-UHFFFAOYSA-N -HMDB0000226 156.017106626 "Orotic acid" C5H4N2O4 PXQPEWDEAKTCGB-UHFFFAOYSA-N -HMDB0000227 148.073558872 "Mevalonic acid" C6H12O4 KJTLQQUUPVSXIM-UHFFFAOYSA-N -HMDB0000228 94.041864814 Phenol C6H6O ISWSIDIOOBJBQZ-UHFFFAOYSA-N -HMDB0000230 309.105981211 "N-Acetylneuraminic acid" C11H19NO9 SQVRNKJHWKZAKO-PFQGKNLYSA-N -HMDB0000235 265.112306876 Thiamine C12H17N4OS JZRWCGZRTZMZEH-UHFFFAOYSA-N -HMDB0000237 74.036779436 "Propionic acid" C3H6O2 XBDQKXXYIPTUBI-UHFFFAOYSA-N -HMDB0000239 169.073893223 Pyridoxine C8H11NO3 LXNHXLLTXMVWPM-UHFFFAOYSA-N -HMDB0000243 88.016043994 "Pyruvic acid" C3H4O3 LCTONWCANYUPML-UHFFFAOYSA-N -HMDB0000244 376.138284392 Riboflavin C17H20N4O6 AUNGANRZJHBGPY-SCRDCRAPSA-N -HMDB0000246 72.057514878 Tetrahydrofuran C4H8O WYURNTSHIVDZCO-UHFFFAOYSA-N -HMDB0000247 182.07903818 Sorbitol C6H14O6 FBPFZTCFMRRESA-JGWLITMVSA-N -HMDB0000251 125.014663785 Taurine C2H7NO3S XOAAWQZATWQOTB-UHFFFAOYSA-N -HMDB0000252 299.282429433 Sphingosine C18H37NO2 WWUZIQQURGPMPG-CCEZHUSRSA-N -HMDB0000254 118.02660868 "Succinic acid" C4H6O4 KDYFGRWQOYBRFD-UHFFFAOYSA-N -HMDB0000256 410.3912516 Squalene C30H50 YYGNTYWPHWGJRM-FLHYQJCXSA-N -HMDB0000258 342.116211546 Sucrose C12H22O11 CZMRCDWAGMRECN-UGDNZRGBSA-N -HMDB0000259 176.094963016 Serotonin C10H12N2O QZAYGJVTTNCVMB-UHFFFAOYSA-N -HMDB0000262 126.042927446 Thymine C5H6N2O2 RWQNBRDOKXIBIV-UHFFFAOYSA-N -HMDB0000267 129.042593095 "Pyroglutamic acid" C5H7NO3 ODHCTXKNWHHXJC-VKHMYHEASA-N -HMDB0000269 301.298079497 Sphinganine C18H39NO2 OTKJDMGTUTTYMP-ZWKOTPCHSA-N -HMDB0000271 89.047678473 Sarcosine C3H7NO2 FSYKKLYZXJSNPZ-UHFFFAOYSA-N -HMDB0000273 242.090271568 Thymidine C10H14N2O5 IQFYYKKMVGJFEH-XLPZGREQSA-N -HMDB0000279 276.132136382 Saccharopine C11H20N2O6 ZDGJAHTZVHVLOT-YUMQZZPRSA-N -HMDB0000283 150.05282343 D-Ribose C5H10O5 HMFHBZSHGGEWLO-SOOFDHNKSA-N -HMDB0000286 566.055020376 "Uridine diphosphate glucose" C15H24N2O17P2 HSCJRCZFDFQWRP-LPTOLDDLSA-N -HMDB0000288 324.035866536 "Uridine 5'-monophosphate" C9H13N2O9P DJJCXFVJDGTHFX-XVFCMESISA-N -HMDB0000289 168.028340014 "Uric acid" C5H4N4O3 LEHOTFFKMJEONL-UHFFFAOYSA-N -HMDB0000291 198.05282343 "Vanillylmandelic acid" C9H10O5 CGQCWMIAEPEHNQ-QMMMGPOBSA-N -HMDB0000292 152.033425392 Xanthine C5H4N4O2 LRFVTYWOQMYALW-UHFFFAOYSA-N -HMDB0000294 60.03236276 Urea CH4N2O XSQUKJJJFZCRTK-UHFFFAOYSA-N -HMDB0000296 244.069536126 Uridine C9H12N2O6 DRTQHJPVMGBUCF-XVFCMESISA-N -HMDB0000299 284.075684136 Xanthosine C10H12N4O6 UBORTCNDUKBEOP-UUOKFMHZSA-N -HMDB0000300 112.027277382 Uracil C4H4N2O2 ISAKRJDGNUQOIC-UHFFFAOYSA-N -HMDB0000301 138.042927446 "Urocanic acid" C6H6N2O2 LOIYMIARKYCTBW-OWOJBTEDSA-N -HMDB0000303 160.100048394 Tryptamine C10H12N2 APJYDQYYACXCRM-UHFFFAOYSA-N -HMDB0000305 286.229665582 "Vitamin A" C20H30O FPIPGXGPPPQFEQ-OVSJKPMPSA-N -HMDB0000306 137.084063979 Tyramine C8H11NO DZGWFCGJZKJUFP-UHFFFAOYSA-N -HMDB0000308 374.282095082 "3b-Hydroxy-5-cholenoic acid" C24H38O3 HIAJCGFYHIANNA-QIZZZRFXSA-N -HMDB0000317 132.07864425 "2-Hydroxy-3-methylpentanoic acid" C6H12O3 RILPIWOPNGRASR-RFZPGFLSSA-N -HMDB0000321 162.05282343 "2-Hydroxyadipic acid" C6H10O5 OTTXIFWBPRRYOG-UHFFFAOYSA-N -HMDB0000325 190.084123558 "3-Hydroxysuberic acid" C8H14O5 ARJZZFJXSNJKGR-UHFFFAOYSA-N -HMDB0000332 376.188588628 18-Oxocortisol C21H28O6 XUQWWIFROYJHCU-FJNAKSJRSA-N -HMDB0000337 120.042258744 "(S)-3,4-Dihydroxybutyric acid" C4H8O4 DZAIOXUZHHTJKN-UHFFFAOYSA-N -HMDB0000350 218.115423686 "3-Hydroxysebacic acid" C10H18O5 OQYZCCKCJQWHIE-UHFFFAOYSA-N -HMDB0000355 162.05282343 "3-Hydroxymethylglutaric acid" C6H10O5 NPOAOTPXWNWTSH-UHFFFAOYSA-N -HMDB0000357 104.047344122 "3-Hydroxybutyric acid" C4H8O3 WHBMMWSBFZVSSR-UHFFFAOYSA-N -HMDB0000359 434.339609961 "3alpha,7alpha-Dihydroxycoprostanic acid" C27H46O4 ITZYGDKGRKKBSN-HKFUITGCSA-N -HMDB0000365 290.224580204 Epiandrosterone C19H30O2 QGXBDMJGAMFCBF-QRIARFFBSA-N -HMDB0000375 166.062994186 "3-(3-Hydroxyphenyl)propanoic acid" C9H10O3 QVWAEZJXDYOKEH-UHFFFAOYSA-N -HMDB0000379 206.042652674 "2-Methylcitric acid" C7H10O7 YNOXCRMFGMSKIJ-UHFFFAOYSA-N -HMDB0000387 216.172544634 "3-Hydroxydodecanoic acid" C12H24O3 MUCMKTPAZLSKTL-UHFFFAOYSA-N -HMDB0000391 406.271924326 "7-Ketodeoxycholic acid" C24H38O5 RHCPKKNRWFXMAT-RRWYKFPJSA-N -HMDB0000396 118.062994186 "2-Ethylhydracrylic acid" C5H10O3 ZMZQVAUJTDKQGE-UHFFFAOYSA-N -HMDB0000400 406.271924326 "3,7-Dihydroxy-12-oxocholanoic acid" C24H38O5 MIHNUBCEFJLAGN-DMMBONCOSA-N -HMDB0000402 176.068473494 "2-Isopropylmalic acid" C7H12O5 BITYXLXUCSKTJS-ZETCQYMHSA-N -HMDB0000407 118.062994186 "2-Hydroxy-3-methylbutyric acid" C5H10O3 NGEWQZIDQIYUNV-UHFFFAOYSA-N -HMDB0000415 408.28757439 "3a,6b,7b-Trihydroxy-5b-cholanoic acid" C24H40O5 DKPMWHFRUGMUKF-CRKPLTDNSA-N -HMDB0000416 412.191959446 "17-Hydroxypregnenolone sulfate" C21H32O6S OMOKWYAQVYBHMG-QUPIPBJSSA-N -HMDB0000417 312.302830524 "3D,7D,11D-Phytanic acid" C20H40O2 RLCKHJSFHOZMDR-GUDVDZBRSA-N -HMDB0000418 378.204238692 18-Hydroxycortisol C21H30O6 HESFZGWRDUVOMS-FJNAKSJRSA-N -HMDB0000422 146.057908808 "2-Methylglutaric acid" C6H10O4 AQYCMVICBNBXNA-UHFFFAOYSA-N -HMDB0000423 182.057908808 "3,4-Dihydroxyhydrocinnamic acid" C9H10O4 DZAUWHJDUNRCTF-UHFFFAOYSA-N -HMDB0000426 148.037173366 "Citramalic acid" C5H8O5 XFTRTWQBIOMVPK-UHFFFAOYSA-N -HMDB0000434 196.073558872 "Homoveratric acid" C10H12O4 WUAXWQRULBZETB-UHFFFAOYSA-N -HMDB0000439 169.037507717 2-Furoylglycine C7H7NO4 KSPQDMRTZZYQLM-UHFFFAOYSA-N -HMDB0000440 152.047344122 "3-Hydroxyphenylacetic acid" C8H8O3 FVMDYYGIDFPZAX-UHFFFAOYSA-N -HMDB0000446 188.116092388 N-Alpha-acetyllysine C8H16N2O3 VEYYWZRYIYDQJM-UHFFFAOYSA-N -HMDB0000448 146.057908808 "Adipic acid" C6H10O4 WNLRTRBMVRJNCN-UHFFFAOYSA-N -HMDB0000450 162.100442324 5-Hydroxylysine C6H14N2O3 YSMODUONRAFBET-UHNVWZDZSA-N -HMDB0000451 158.094294314 "cis-4-Hydroxycyclohexylacetic acid" C8H14O3 ALTAAUJNHYWOGS-UHFFFAOYSA-N -HMDB0000452 103.063328537 "L-alpha-Aminobutyric acid" C4H9NO2 QWCKQJZIFLGMSD-VKHMYHEASA-N -HMDB0000453 114.068079564 Delta-Hexanolactone C6H10O2 RZTOWFMDBDPERY-UHFFFAOYSA-N -HMDB0000462 158.043990078 Allantoin C4H6N4O3 POJWUDADGALRAB-UHFFFAOYSA-N -HMDB0000466 131.073499293 3-Methylindole C9H9N ZFRKQXVRDFCRJG-UHFFFAOYSA-N -HMDB0000467 390.277009704 "Nutriacholic acid" C24H38O4 DXOCDBGWDZAYRQ-QPVZPPSOSA-N -HMDB0000472 220.08479226 5-Hydroxy-L-tryptophan C11H12N2O3 LDCYZAJDBXYCGN-VIFPVBQESA-N -HMDB0000474 72.057514878 Butanone C4H8O ZWEHNKRNPOVVGH-UHFFFAOYSA-N -HMDB0000477 252.20893014 "7Z,10Z-Hexadecadienoic acid" C16H28O2 WPJGPAAPSBVXNU-HZJYTTRNSA-N -HMDB0000479 169.085126611 3-Methylhistidine C7H11N3O2 JDHILDINMRGULE-LURJTMIESA-N -HMDB0000482 144.115029756 "Caprylic acid" C8H16O2 WWZKQHOCKIZLMA-UHFFFAOYSA-N -HMDB0000483 452.350174646 5b-Cholestane-3a,7a,12a,23S,25-pentol C27H48O5 OXSBBBPDYVCAKC-CTSLUMRNSA-N -HMDB0000484 168.042258738 "Vanillic acid" C8H8O4 WKOLLVMJNQIZCI-UHFFFAOYSA-N -HMDB0000486 160.109944378 "7-Hydroxyoctanoic acid" C8H16O3 OFCMTSZRXXFMBQ-UHFFFAOYSA-N -HMDB0000489 335.132864663 Aspartylglycosamine C12H21N3O8 YTTRPBWEMMPYSW-HRRFRDKFSA-N -HMDB0000491 130.062994186 "3-Methyl-2-oxovaleric acid" C6H10O3 JVQYSWDUAOAHFM-UHFFFAOYSA-N -HMDB0000494 416.401816294 Stigmastanol C29H52O LGJMUZUPVCAVPU-KZXGMYDKSA-N -HMDB0000500 138.031694053 "4-Hydroxybenzoic acid" C7H6O3 FJKROLUGYXJWQN-UHFFFAOYSA-N -HMDB0000502 406.271924324 "3-Oxocholic acid" C24H38O5 OEKUSRBIIZNLHZ-DJDNIQJZSA-N -HMDB0000508 152.068473494 Ribitol C5H12O5 HEBKCHPVOIAQTA-ZXFHETKHSA-N -HMDB0000510 161.068807845 "Aminoadipic acid" C6H11NO4 OYIFNHCXNCRBQI-UHFFFAOYSA-N -HMDB0000511 172.146329884 "Capric acid" C10H20O2 GHVNFZFCNZKVNT-UHFFFAOYSA-N -HMDB0000512 207.089543287 N-Acetyl-L-phenylalanine C11H13NO3 CBQJSKKFNMDLON-JTQLQIEISA-N -HMDB0000516 180.063388116 Beta-D-Glucose C6H12O6 WQZGKKKJIJFFOK-VFUOTHLCSA-N -HMDB0000517 174.111675712 L-Arginine C6H14N4O2 ODKSFYDXXFIFQN-BYPYZUCNSA-N -HMDB0000518 392.292659768 "Chenodeoxycholic acid" C24H40O4 RUDATBOHQWOJDD-BSWAIDMHSA-N -HMDB0000520 436.355260024 5a-Cholestane-3a,7a,12a,25-tetrol C27H48O4 NTIXPPFPXLYJCT-SUGKMTRFSA-N -HMDB0000522 144.042258744 "3-Methylglutaconic acid" C6H8O4 WKRBKYFIJPGYQC-DUXPYHPUSA-N -HMDB0000525 132.07864425 "5-Hydroxyhexanoic acid" C6H12O3 YDCRNMJQROAWFT-UHFFFAOYSA-N -HMDB0000528 158.03275669 "4,5-Dihydroorotic acid" C5H6N2O4 UFIVEPVSAGBUSI-UHFFFAOYSA-N -HMDB0000529 198.161979948 "5Z-Dodecenoic acid" C12H22O2 IJBFSOLHRKELLR-FPLPWBNLSA-N -HMDB0000531 118.062994186 "3-Hydroxyvaleric acid" C5H10O3 REKYPYSUBKSCAT-UHFFFAOYSA-N -HMDB0000532 117.042593095 Acetylglycine C4H7NO3 OKJIRPAQVSHGFK-UHFFFAOYSA-N -HMDB0000535 116.083729628 "Caproic acid" C6H12O2 FUZZWVXGSFPDMH-UHFFFAOYSA-N -HMDB0000539 166.047738052 "Arabinonic acid" C5H10O6 QXKAIJAYHKCRRA-JJYYJPOSSA-N -HMDB0000549 86.036779436 Gamma-Butyrolactone C4H6O2 YEJRWHAVMIAJKC-UHFFFAOYSA-N -HMDB0000552 289.152537473 3-Methylglutarylcarnitine C13H23NO6 HFCPFJNSBPQJDP-UHFFFAOYSA-N -HMDB0000553 312.302830524 "3L,7D,11D-Phytanic acid" C20H40O2 RLCKHJSFHOZMDR-QRVBRYPASA-N -HMDB0000555 160.073558872 "3-Methyladipic acid" C7H12O4 SYEOWUNSTUDKGM-YFKPBYRVSA-N -HMDB0000557 131.094628665 L-Alloisoleucine C6H13NO2 AGPKZVBTJJNPAG-UHNVWZDZSA-N -HMDB0000562 113.058911861 Creatinine C4H7N3O DDRJAANPRJIHGJ-UHFFFAOYSA-N -HMDB0000563 166.062994186 "D-Phenyllactic acid" C9H10O3 VOXXWSYKYCBWHO-QMMMGPOBSA-N -HMDB0000564 733.562155053 PC(16:0/16:0) C40H80NO8P KILNVBDSWZSGLL-KXQOOQHDSA-N -HMDB0000565 196.058302738 "Galactonic acid" C6H12O7 RGHNJXZEOKUKBD-MGCNEYSASA-N -HMDB0000567 148.0524295 "Cinnamic acid" C9H8O2 WBYWAXJHAXSJNI-SREVYHEPSA-N -HMDB0000568 152.068473494 D-Arabitol C5H12O5 HEBKCHPVOIAQTA-QWWZWVQMSA-N -HMDB0000573 282.255880332 "Elaidic acid" C18H34O2 ZQPPMHVWECSIRJ-MDZDMXLPSA-N -HMDB0000574 121.019749163 L-Cysteine C3H7NO2S XUJNEKJLAYXESH-REOHCLBHSA-N -HMDB0000577 388.370516158 5beta-Coprostanol C27H48O QYIXCDOBOSTCEI-NWKZBHTNSA-N -HMDB0000593 785.593455181 "PC(18:1(9Z)/18:1(9Z)) " C44H84NO8P SNKAWJBJQDLSFF-YEUCEMRASA-N -HMDB0000594 294.121571696 gamma-Glutamylphenylalanine C14H18N2O5 XHHOHZPNYFQJKL-QWRGUYRKSA-N -HMDB0000606 148.037173366 "D-2-Hydroxyglutaric acid" C5H8O5 HWXBTNAVRSUOJR-GSVOUGTGSA-N -HMDB0000610 648.584531687 CE(18:2(9Z,12Z)) C45H76O2 NAACPBBQTFFYQB-XHDSEGDBSA-N -HMDB0000613 136.037173366 "Erythronic acid" C4H8O5 JPIJQSOTBSSVTP-PWNYCUMCSA-N -HMDB0000617 112.016043994 "2-Furoic acid" C5H4O3 SMNDYUVBFMFKNZ-UHFFFAOYSA-N -HMDB0000619 408.28757439 "Cholic acid" C24H40O5 BHQCQFFYRZLCQQ-OELDTZBJSA-N -HMDB0000621 150.05282343 D-Ribulose C5H10O5 ZAQJHHRNXZUBTE-NQXXGFSBSA-N -HMDB0000622 132.042258744 "Ethylmalonic acid" C5H8O4 UKFXDFUAPNAMPJ-UHFFFAOYSA-N -HMDB0000623 230.151809192 "Dodecanedioic acid" C12H22O4 TVIDDXQYHWJXFK-UHFFFAOYSA-N -HMDB0000625 196.058302738 "Gluconic acid" C6H12O7 RGHNJXZEOKUKBD-SQOUGZDYSA-N -HMDB0000626 392.292659768 "Deoxycholic acid" C24H40O4 KXGVEGMKQFWNSR-LLQZFEROSA-N -HMDB0000630 111.043261797 Cytosine C4H5N3O OPTASPLRGRRNAP-UHFFFAOYSA-N -HMDB0000631 449.314123491 "Deoxycholic acid glycine conjugate" C26H43NO5 WVULKSPCQVQLCU-ZMBDPXIHSA-N -HMDB0000634 130.02660868 "Citraconic acid" C5H6O4 HNEGQIOMVPPMNR-IHWYPQMZSA-N -HMDB0000637 449.314123491 "Chenodeoxycholic acid glycine conjugate" C26H43NO5 GHCZAUBVMUEKKP-AHBZRTSYSA-N -HMDB0000638 200.177630012 "Dodecanoic acid" C12H24O2 POULHZVOKOAJMA-UHFFFAOYSA-N -HMDB0000640 162.05282343 Levoglucosan C6H10O5 TWNIBLMWSKIRAT-VFUOTHLCSA-N -HMDB0000641 146.069142196 L-Glutamine C5H10N2O3 ZDXPYRJPNDTMRX-VKHMYHEASA-N -HMDB0000646 150.05282343 L-Arabinose C5H10O5 SRBFZHDQGSBBOR-HWQSCIPKSA-N -HMDB0000650 103.063328537 "D-alpha-Aminobutyric acid" C4H9NO2 QWCKQJZIFLGMSD-GSVOUGTGSA-N -HMDB0000651 315.240958549 Decanoylcarnitine C17H33NO4 LZOSYCMHQXPBFU-UHFFFAOYSA-N -HMDB0000660 180.063388116 D-Fructose C6H12O6 RFSUNEUAIZKAJO-ARQDHWQXSA-N -HMDB0000661 132.042258744 "Glutaric acid" C5H8O4 JFCQEDHGNNZCLN-UHFFFAOYSA-N -HMDB0000663 210.037567296 "Glucaric acid" C6H10O8 DSLZVSRJTYRBFB-LLEIAEIESA-N -HMDB0000665 132.07864425 "Leucinic acid" C6H12O3 LVRFTAZAXQPQHI-UHFFFAOYSA-N -HMDB0000666 130.099379692 "Heptanoic acid" C7H14O2 MNWFXJYAOYHMED-UHFFFAOYSA-N -HMDB0000669 152.047344122 "Ortho-Hydroxyphenylacetic acid" C8H8O3 CCVYRRGZDBSHFU-UHFFFAOYSA-N -HMDB0000670 188.127325776 Homo-L-arginine C7H16N4O2 QUOGESRFPZDMMT-YFKPBYRVSA-N -HMDB0000671 205.073893223 "Indolelactic acid" C11H11NO3 XGILAAMKEQUXLS-UHFFFAOYSA-N -HMDB0000672 286.214409448 "Hexadecanedioic acid" C16H30O4 QQHJDPROMQRDLA-UHFFFAOYSA-N -HMDB0000673 280.240230268 "Linoleic acid" C18H32O2 OYHQOLUKZRVURQ-HZJYTTRNSA-N -HMDB0000678 159.089543287 Isovalerylglycine C7H13NO3 ZRQXMKMBBMNNQC-UHFFFAOYSA-N -HMDB0000679 189.111341361 Homocitrulline C7H15N3O3 XIGSAGMEBXLVJJ-YFKPBYRVSA-N -HMDB0000682 213.009578407 "Indoxyl sulfate" C8H7NO4S BXFFHSIDQOFMLE-UHFFFAOYSA-N -HMDB0000684 208.08479226 L-Kynurenine C10H12N2O3 YGPSJZOEDVAXAB-QMMMGPOBSA-N -HMDB0000687 131.094628665 L-Leucine C6H13NO2 ROHFNLRQFUQHCH-YFKPBYRVSA-N -HMDB0000689 116.083729628 "Isocaproic acid" C6H12O2 FGKJLKRYENPLQH-UHFFFAOYSA-N -HMDB0000691 104.010958616 "Malonic acid" C3H4O4 OFOBLEOULBTSOW-UHFFFAOYSA-N -HMDB0000694 148.037173366 "L-2-Hydroxyglutaric acid" C5H8O5 HWXBTNAVRSUOJR-VKHMYHEASA-N -HMDB0000695 130.062994186 Ketoleucine C6H10O3 BKAJNAXTPSGJCU-UHFFFAOYSA-N -HMDB0000696 149.051049291 L-Methionine C5H11NO2S FFEARJCKVFRZRR-BYPYZUCNSA-N -HMDB0000698 433.319208869 "Lithocholic acid glycine conjugate" C26H43NO4 XBSQTYHEGZTYJE-OETIFKLTSA-N -HMDB0000699 137.07148792 1-Methylnicotinamide C7H9N2O LDHMAVIPBRSVRG-UHFFFAOYSA-O -HMDB0000700 90.031694058 "Hydroxypropionic acid" C3H6O3 ALRHLSYJTWAHJZ-UHFFFAOYSA-N -HMDB0000701 173.105193351 Hexanoylglycine C8H15NO3 UPCKIPHSXMXJOX-UHFFFAOYSA-N -HMDB0000703 152.047344122 "Mandelic acid" C8H8O3 IWYDHOAUDWTVEP-ZETCQYMHSA-N -HMDB0000705 259.178358293 Hexanoylcarnitine C13H25NO4 VVPRQWTYSNDTEA-UHFFFAOYSA-N -HMDB0000706 280.105921632 Aspartylphenylalanine C13H16N2O5 YZQCXOFQZKCETR-UWVGGRQHSA-N -HMDB0000707 180.042258744 "4-Hydroxyphenylpyruvic acid" C9H8O4 KKADPXVIOXHVKN-UHFFFAOYSA-N -HMDB0000708 449.314123491 "Glycoursodeoxycholic acid" C26H43NO5 GHCZAUBVMUEKKP-XROMFQGDSA-N -HMDB0000710 104.047344122 "4-Hydroxybutyric acid" C4H8O3 SJZRECIVHVDYJC-UHFFFAOYSA-N -HMDB0000711 160.109944378 "Hydroxyoctanoic acid" C8H16O3 JKRDADVRIYVCCY-UHFFFAOYSA-N -HMDB0000712 429.309038113 "Hexadecanedioic acid mono-L-carnitine ester" C23H43NO6 UNHCPLSWMNPZTD-UHFFFAOYSA-N -HMDB0000714 179.058243159 "Hippuric acid" C9H9NO3 QIAFMBKCNZACKA-UHFFFAOYSA-N -HMDB0000715 189.042593095 "Kynurenic acid" C10H7NO3 HCZHHEIFKROPDY-UHFFFAOYSA-N -HMDB0000716 129.078978601 "L-Pipecolic acid" C6H11NO2 HXEACLLIILLPRG-YFKPBYRVSA-N -HMDB0000717 376.297745146 "Isolithocholic acid" C24H40O3 SMEROWZSTRWXGI-WFVDQZAMSA-N -HMDB0000718 102.068079564 "Isovaleric acid" C5H10O2 GWYFCOCPABKNJV-UHFFFAOYSA-N -HMDB0000719 119.058243159 L-Homoserine C4H9NO3 UKAUYVFTDYCKQA-VKHMYHEASA-N -HMDB0000720 116.047344122 "Levulinic acid" C5H8O3 JOOXCMJARBKPKM-UHFFFAOYSA-N -HMDB0000721 172.08479226 Glycylproline C7H12N2O3 KZNQNBZMBZJQJO-UHFFFAOYSA-N -HMDB0000722 483.301844245 Lithocholyltaurine C26H45NO5S QBYUNVOYXHFVKC-LVMSMGIASA-N -HMDB0000725 131.058243159 4-Hydroxyproline C5H9NO3 PMMYEEVYMWASQN-DMTCNVIQSA-N -HMDB0000729 104.047344122 "Alpha-Hydroxyisobutyric acid" C4H8O3 BWLBGMIXKSTLSX-UHFFFAOYSA-N -HMDB0000730 145.073893223 Isobutyrylglycine C6H11NO3 DCICDMMXFIELDF-UHFFFAOYSA-N -HMDB0000731 200.976563719 Cysteine-S-sulfate C3H7NO5S2 NOKPBJYHPHHWAN-REOHCLBHSA-N -HMDB0000734 187.063328537 "Indoleacrylic acid" C11H9NO2 SXOUIMVOMIGLHO-AATRIKPKSA-N -HMDB0000738 117.057849229 Indole C8H7N SIKJAQJRHWYJAI-UHFFFAOYSA-N -HMDB0000742 135.035399227 Homocysteine C4H9NO2S FFFHZYDWPBMWHY-UHFFFAOYSA-N -HMDB0000744 134.021523302 "Malic acid" C4H6O5 BJEPYKJPYRNKOW-UHFFFAOYSA-N -HMDB0000746 132.07864425 "Hydroxyisocaproic acid" C6H12O3 LVRFTAZAXQPQHI-YFKPBYRVSA-N -HMDB0000748 166.062994186 "L-3-Phenyllactic acid" C9H10O3 VOXXWSYKYCBWHO-MRVPVSSYSA-N -HMDB0000750 168.042258744 "3-Hydroxymandelic acid" C8H8O4 OLSDAJRAVOVKLG-UHFFFAOYSA-N -HMDB0000752 146.057908808 "Methylglutaric acid" C6H10O4 XJMMNTGIMDZPMU-UHFFFAOYSA-N -HMDB0000753 100.088815006 3-Hexanone C6H12O PFCHFHIRKBAQGU-UHFFFAOYSA-N -HMDB0000754 118.062994186 "3-Hydroxyisovaleric acid" C5H10O3 AXFYFNCPONWUHW-UHFFFAOYSA-N -HMDB0000755 182.057908808 "Hydroxyphenyllactic acid" C9H10O4 JVGVDSSUAVXRDY-UHFFFAOYSA-N -HMDB0000759 188.116092388 Glycylleucine C8H16N2O3 DKEXFJVMVGETOO-LURJTMIESA-N -HMDB0000760 408.28757439 "Hyocholic acid" C24H40O5 DKPMWHFRUGMUKF-NNFRHCBVSA-N -HMDB0000761 376.297745146 "Lithocholic acid" C24H40O3 SMEROWZSTRWXGI-HVATVPOCSA-N -HMDB0000763 191.058243159 "5-Hydroxyindoleacetic acid" C10H9NO3 DUUGKQCEGZLZNO-UHFFFAOYSA-N -HMDB0000764 150.068079564 "Hydrocinnamic acid" C9H10O2 XMIIGOLPHOKFCH-UHFFFAOYSA-N -HMDB0000765 182.07903818 Mannitol C6H14O6 FBPFZTCFMRRESA-KVTDHHQDSA-N -HMDB0000766 131.058243159 N-Acetyl-L-alanine C5H9NO3 KTHDTJVBEPMMGL-VKHMYHEASA-N -HMDB0000767 244.069536126 Pseudouridine C9H12N2O6 PTJWIQPHWPFNBW-GBNDHIKLSA-N -HMDB0000772 298.28718046 "Nonadecanoic acid" C19H38O2 ISYWECDDZWTKFF-UHFFFAOYSA-N -HMDB0000774 396.197044824 "Pregnenolone sulfate" C21H32O5S DIJBBUIOWGGQOP-OZIWPBGVSA-N -HMDB0000779 166.062994186 "Phenyllactic acid" C9H10O3 VOXXWSYKYCBWHO-UHFFFAOYSA-N -HMDB0000782 314.245709576 "Octadecanedioic acid" C18H34O4 BNJOQKFENDDGSC-UHFFFAOYSA-N -HMDB0000783 131.058243159 Propionylglycine C5H9NO3 WOMAZEJKVZLLFE-UHFFFAOYSA-N -HMDB0000784 188.104859 "Azelaic acid" C9H16O4 BDJRBEYXGGNYIS-UHFFFAOYSA-N -HMDB0000791 287.209658421 L-Octanoylcarnitine C15H29NO4 CXTATJFJDMJMIY-CYBMUJFWSA-N -HMDB0000792 202.120509064 "Sebacic acid" C10H18O4 CXMXRPHRNRROMY-UHFFFAOYSA-N -HMDB0000798 158.13067982 "Oenanthic ether" C9H18O2 TVQGDYNRXLTQAP-UHFFFAOYSA-N -HMDB0000801 312.302830524 "Phytanic acid" C20H40O2 RLCKHJSFHOZMDR-UHFFFAOYSA-N -HMDB0000802 163.049409807 Pterin C6H5N5O HNXQXTQTPAJEJL-UHFFFAOYSA-N -HMDB0000803 221.089937217 beta-N-Acetylglucosamine C8H15NO6 OVRNDRQMDRJTHS-FMDGEEDCSA-N -HMDB0000806 228.20893014 "Myristic acid" C14H28O2 TUNFSRHWOTWDNC-UHFFFAOYSA-N -HMDB0000808 145.073893223 N-Butyrylglycine C6H11NO3 WPSSBBPLVMTKRN-UHFFFAOYSA-N -HMDB0000812 175.048072403 "N-Acetyl-L-aspartic acid" C6H9NO5 OTCCIMWXFLJLIA-BYPYZUCNSA-N -HMDB0000819 183.089543287 Normetanephrine C9H13NO3 YNYAYWLBAHXHLL-UHFFFAOYSA-N -HMDB0000820 60.057514878 "Propyl alcohol" C3H8O BDERNNFJNOPAEC-UHFFFAOYSA-N -HMDB0000822 168.042258744 "p-Hydroxymandelic acid" C8H8O4 YHXHKYRQLYQUIH-UHFFFAOYSA-N -HMDB0000824 217.131408101 Propionylcarnitine C10H19NO4 UFAHZIUFPNSHSL-UHFFFAOYSA-N -HMDB0000826 242.224580204 "Pentadecanoic acid" C15H30O2 WQEPLUUGTLDZJY-UHFFFAOYSA-N -HMDB0000827 284.271530396 "Stearic acid" C18H36O2 QIQXTHQIDYTFRH-UHFFFAOYSA-N -HMDB0000828 176.043321376 "Ureidosuccinic acid" C5H8N2O5 HLKXYZVTANABHZ-REOHCLBHSA-N -HMDB0000840 195.053157781 "Salicyluric acid" C9H9NO4 ONJSZLXSECQROL-UHFFFAOYSA-N -HMDB0000845 253.081103865 Neopterin C9H11N5O4 BMQYVXCPAOLZOK-UHFFFAOYSA-N -HMDB0000847 158.13067982 "Pelargonic acid" C9H18O2 FBUKVWPVBMHYJY-UHFFFAOYSA-N -HMDB0000848 427.366159062 Stearoylcarnitine C25H49NO4 FNPHNLNTJNMAEE-HSZRJFAPSA-N -HMDB0000849 164.068473494 Rhamnose C6H12O5 SHZGCJCMOBCMKK-JFNONXLTSA-N -HMDB0000852 414.38616623 beta-Sitosterol C29H50O KZJWDPNRJALLNS-VJSFXXLFSA-N -HMDB0000853 221.089937217 N-Acetyl-b-D-galactosamine C8H15NO6 OVRNDRQMDRJTHS-JAJWTYFOSA-N -HMDB0000854 174.064056818 "Formiminoglutamic acid" C6H10N2O4 NRXIKWMTVXPVEF-BYPYZUCNSA-N -HMDB0000855 255.0980966 "Nicotinamide riboside" C11H15N2O5 JLEBZPBDRKPWTD-TURQNECASA-O -HMDB0000856 217.106255983 N-a-Acetylcitrulline C8H15N3O4 WMQMIOYQXNRROC-UHFFFAOYSA-N -HMDB0000857 160.073558872 "Pimelic acid" C7H12O4 WLJVNTCWHIRURA-UHFFFAOYSA-N -HMDB0000863 60.057514878 "Isopropyl alcohol" C3H8O KFZMGEQAYNKOFK-UHFFFAOYSA-N -HMDB0000866 223.084457909 N-Acetyl-L-tyrosine C11H13NO4 CAHKINHBCWCHCF-JTQLQIEISA-N -HMDB0000867 166.047738052 "Ribonic acid" C5H10O6 QXKAIJAYHKCRRA-BXXZVTAOSA-N -HMDB0000870 111.079647303 Histamine C5H9N3 NTYJJOPFIAHURM-UHFFFAOYSA-N -HMDB0000872 258.18310932 "Tetradecanedioic acid" C14H26O4 HQHCYKULIHKCEB-UHFFFAOYSA-N -HMDB0000873 124.0524295 4-Methylcatechol C7H8O2 ZBCATMYQYDCTIZ-UHFFFAOYSA-N -HMDB0000874 499.296758867 "Tauroursodeoxycholic acid" C26H45NO6S BHTRKEVKTKCXOH-VSHSPWMTSA-N -HMDB0000875 137.047678473 Trigonelline C7H7NO2 WWNNZCOKKKDOPX-UHFFFAOYSA-N -HMDB0000878 396.33921603 Ergosterol C28H44O DNVPQKQSNYMLRS-KQYMERMZSA-N -HMDB0000879 334.250794954 Tetrahydrodeoxycorticosterone C21H34O3 CYKYBWRSLLXBOW-GDYGHMJCSA-N -HMDB0000881 205.037507717 "Xanthurenic acid" C10H7NO4 FBZONXHGGPHHIY-UHFFFAOYSA-N -HMDB0000883 117.078978601 L-Valine C5H11NO2 KZSNJWFQEVHDMF-BYPYZUCNSA-N -HMDB0000884 258.08518619 Ribothymidine C10H14N2O6 DWRXFEITVBNRMK-JXOAFFINSA-N -HMDB0000888 216.136159128 "Undecanedioic acid" C11H20O4 LWBHHRRTOZQPDM-UHFFFAOYSA-N -HMDB0000892 102.068079564 "Valeric acid" C5H10O2 NQPDZGIKBAWPEJ-UHFFFAOYSA-N -HMDB0000893 174.089208936 "Suberic acid" C8H14O4 TYFQFVWCELRYAO-UHFFFAOYSA-N -HMDB0000896 499.296758867 "Taurodeoxycholic acid" C26H45NO6S AWDRATDZQPNJFN-VAYUFCLWSA-N -HMDB0000897 165.065059871 7-Methylguanine C6H7N5O FZWGECJQACGGTI-UHFFFAOYSA-N -HMDB0000898 125.095297367 1-Methylhistamine C6H11N3 FHQDWPCFSJMNCT-UHFFFAOYSA-N -HMDB0000903 364.224974134 Tetrahydrocortisone C21H32O5 SYGWGHVTLUBCEM-SDYDLROXSA-N -HMDB0000904 175.095691297 Citrulline C6H13N3O3 RHGKLRLOHDJJDR-BYPYZUCNSA-N -HMDB0000905 331.068169717 "Deoxyadenosine monophosphate" C10H14N5O6P KHWCHTKSEGGWEX-RRKCRQDMSA-N -HMDB0000906 59.073499293 Trimethylamine C3H9N GETQZCLCWQTVFV-UHFFFAOYSA-N -HMDB0000907 456.254559702 "Sulfolithocholic acid" C24H40O6S AXDXVEYHEODSPN-YPLGJCPNSA-N -HMDB0000908 388.370516158 5alpha-Cholestanol C27H48O QYIXCDOBOSTCEI-QCYZZNICSA-N -HMDB0000909 158.094294314 "trans-4-Hydroxycyclohexylacetic acid" C8H14O3 ALTAAUJNHYWOGS-LJGSYFOKSA-N -HMDB0000910 214.193280076 "Tridecanoic acid" C13H26O2 SZHOJFHSIKHZHA-UHFFFAOYSA-N -HMDB0000918 650.600181752 CE(18:1(9Z)) C45H78O2 RJECHNNFRHZQKU-DVPYOPPASA-N -HMDB0000921 384.33921603 Cholestenone C27H44O NYOXRYYXRWJDKP-GYKMGIIDSA-N -HMDB0000925 75.068413915 "Trimethylamine N-oxide" C3H9NO UYPYRKYUKCHHIB-UHFFFAOYSA-N -HMDB0000926 79.042199165 Pyridine C5H5N JUJWROOIHBZHMG-UHFFFAOYSA-N -HMDB0000929 204.089877638 L-Tryptophan C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N -HMDB0000933 228.136159128 "Traumatic acid" C12H20O4 MAZWDMBCPDUFDJ-VQHVLOKHSA-N -HMDB0000937 412.370516166 Stigmasterol C29H48O HCXVJBMSMIARIN-PHZDYDNGSA-N -HMDB0000939 384.12158847 S-Adenosylhomocysteine C14H20N6O5S ZJUKTBDSGOFHSH-WFMPWKQPSA-N -HMDB0000943 136.037173366 "Threonic acid" C4H8O5 JPIJQSOTBSSVTP-GBXIJSLDSA-N -HMDB0000944 340.334130652 "Behenic acid" C22H44O2 UKMSUNONTOPOIO-UHFFFAOYSA-N -HMDB0000946 392.292659768 "Ursodeoxycholic acid" C24H40O4 RUDATBOHQWOJDD-UZVSRGJWSA-N -HMDB0000947 186.161979948 "Undecanoic acid" C11H22O2 ZDPHROOEEOARMN-UHFFFAOYSA-N -HMDB0000951 499.296758867 "Taurochenodesoxycholic acid" C26H45NO6S BHTRKEVKTKCXOH-BJLOMENOSA-N -HMDB0000954 194.057908808 "trans-Ferulic acid" C10H10O4 KSEBMYQBYZTDHS-HWKANZROSA-N -HMDB0000955 194.057908808 "Isoferulic acid" C10H10O4 QURCVMIEKCOAJU-HWKANZROSA-N -HMDB0000957 110.036779436 Pyrocatechol C6H6O2 YCIMNLLNPGFGHC-UHFFFAOYSA-N -HMDB0000965 109.019749163 Hypotaurine C2H7NO2S VVIUBCNYACGLLV-UHFFFAOYSA-N -HMDB0000975 342.116211546 Trehalose C12H22O11 HDTRYLNUVZCQOY-LIZSDCNHSA-N -HMDB0000978 207.053157781 "4-(2-Aminophenyl)-2,4-dioxobutanoic acid" C10H9NO4 CAOVWYZQMPNAFJ-UHFFFAOYSA-N -HMDB0000982 257.101170605 5-Methylcytidine C10H15N3O5 ZAYHVCMSTBRABG-JXOAFFINSA-N -HMDB0000990 44.02621475 Acetaldehyde C2H4O IKHGUXGNUITLKF-UHFFFAOYSA-N -HMDB0000991 159.125928793 "DL-2-Aminooctanoic acid" C8H17NO2 AKVBCGQVQXPRLD-UHFFFAOYSA-N -HMDB0001008 582.247834831 Biliverdin C33H34N4O6 QBUVFDKTZJNUPP-BBROENKCSA-N -HMDB0001015 177.045963913 N-Formyl-L-methionine C6H11NO3S PYUSHNKNPOHWEZ-RXMQYKEDSA-N -HMDB0001032 368.165744696 "Dehydroepiandrosterone sulfate" C19H28O5S CZWCKYRVOZZJNM-USOAJAOKSA-N -HMDB0001043 304.240230268 "Arachidonic acid" C20H32O2 YZXBAPSDXZZRGB-DOFZRALJSA-N -HMDB0001049 250.062342258 gamma-Glutamylcysteine C8H14N2O5S RITKHVBHSGLULN-WHFBIAKZSA-N -HMDB0001051 90.031694058 Glyceraldehyde C3H6O3 MNQZXJOMYWMBOU-UHFFFAOYSA-N -HMDB0001067 304.090665498 "N-Acetylaspartylglutamic acid" C11H16N2O8 OPVPGKGADVGKTG-UHFFFAOYSA-N -HMDB0001072 862.683911368 "Coenzyme Q10" C59H90O4 ACTIUHUUMQJHFO-UPTCCGCDSA-N -HMDB0001078 260.029718526 "Mannose 6-phosphate" C6H13O9P NBSCHQHZLSJFNQ-RWOPYEJCSA-N -HMDB0001101 152.047344122 "p-Anisic acid" C8H8O3 ZEYHEAKUIGZSGI-UHFFFAOYSA-N -HMDB0001104 220.105921632 N-Acetyl-b-glucosaminylamine C8H16N2O5 MCGXOCXFFNKASF-FMDGEEDCSA-N -HMDB0001123 137.047678473 "2-Aminobenzoic acid" C7H7NO2 RWZYAGGXGHYGMB-UHFFFAOYSA-N -HMDB0001129 221.089937217 N-Acetylmannosamine C8H15NO6 OVRNDRQMDRJTHS-OZRXBMAMSA-N -HMDB0001138 189.063722467 "N-Acetylglutamic acid" C7H11NO5 RFMMMVDNIPUKGG-UHFFFAOYSA-N -HMDB0001139 354.240624198 "Prostaglandin F2a" C20H34O5 PXGPLTODNUVGFL-UAAPODJFSA-N -HMDB0001140 128.120115134 Octanal C8H16O NUJGJRNETVAIRJ-UHFFFAOYSA-N -HMDB0001147 119.021857653 "Aminomalonic acid" C3H5NO4 JINBYESILADKFW-UHFFFAOYSA-N -HMDB0001160 354.349780716 "Tricosanoic acid" C23H46O2 XEZVDURJDFGERA-UHFFFAOYSA-N -HMDB0001161 146.118103761 "4-Trimethylammoniobutanoic acid" C7H16NO2 JHPNVNIEXXLNTR-UHFFFAOYSA-O -HMDB0001170 386.354866094 Lathosterol C27H46O IZVFFXVYBHFIHY-SKCNUYALSA-N -HMDB0001173 297.089560061 5'-Methylthioadenosine C11H15N5O3S WUUGFSXJNOTRMR-IOSLPCCCSA-N -HMDB0001183 130.135765198 Octanol C8H18O KBPLFHHGFOOTCA-UHFFFAOYSA-N -HMDB0001184 84.057514878 "Methyl propenyl ketone" C5H8O LABTWGUMFABVFG-ONEGZZNKSA-N -HMDB0001185 399.145063566 S-Adenosylmethionine C15H23N6O5S MEFKEPWMEQBLKI-AIRLBKTGSA-O -HMDB0001190 159.068413915 Indoleacetaldehyde C10H9NO WHOOUMGHGSPMGR-UHFFFAOYSA-N -HMDB0001202 307.056936329 dCMP C9H14N3O7P NCMVOABPESMRCP-SHYZEUOFSA-N -HMDB0001220 352.224974134 "Prostaglandin E2" C20H32O5 XEYBRNLFEZDVAW-ARSRFYASSA-N -HMDB0001227 322.056601978 "5-Thymidylic acid" C10H15N2O8P GYOZYWVXFNDGLU-XLPZGREQSA-N -HMDB0001229 195.053157781 Dopaquinone C9H9NO4 AHMIDUVKSGCHAU-LURJTMIESA-N -HMDB0001248 785.157134455 FAD C27H33N9O15P2 VWWQXMAJTJZDQX-UYBVJOGSSA-N -HMDB0001251 426.386166222 Lanosterin C30H50O CAHGCLMLTWQZNJ-BQNIITSRSA-N -HMDB0001256 202.215746852 Spermine C10H26N4 PFNFFQXMRSDOHW-UHFFFAOYSA-N -HMDB0001257 145.157897623 Spermidine C7H19N3 ATHGHQPFGPMSJY-UHFFFAOYSA-N -HMDB0001262 504.169034976 Maltotriose C18H32O16 FYGDTMLNYKFZSV-DZOUCCHMSA-N -HMDB0001266 180.063388116 L-Sorbose C6H12O6 LKDRXBCSQODPBY-BGPJRJDNSA-N -HMDB0001310 89.047678473 D-Alanine C3H7NO2 QNAYBMKLOCPYGJ-UWTATZPHSA-N -HMDB0001325 188.152477894 N6,N6,N6-Trimethyl-L-lysine C9H20N2O2 MXNRLFUSFKVQSK-QMMMGPOBSA-N -HMDB0001336 168.042258744 "3,4-Dihydroxybenzeneacetic acid" C8H8O4 CFFZDZCDUFSOFZ-UHFFFAOYSA-N -HMDB0001339 881.146902423 Glutaryl-CoA C26H42N7O19P3S SYKWLIJQEHRDNH-KRPIADGTSA-N -HMDB0001352 104.010958616 "Hydroxypyruvic acid" C3H4O4 HHDDCCUIIUWNGJ-UHFFFAOYSA-N -HMDB0001370 190.095356946 "Diaminopimelic acid" C7H14N2O4 GMKMEZVLHJARHF-WHFBIAKZSA-N -HMDB0001388 278.224580204 "Alpha-Linolenic acid" C18H30O2 DTOSIQBPPRVQHS-PDBXOOCHSA-N -HMDB0001392 137.047678473 "p-Aminobenzoic acid" C7H7NO2 ALYNCZNDIQEVRV-UHFFFAOYSA-N -HMDB0001398 124.052429498 Guaiacol C7H8O2 LHGVFZTZFXWLCP-UHFFFAOYSA-N -HMDB0001401 260.029718526 "Glucose 6-phosphate" C6H13O9P NBSCHQHZLSJFNQ-GASJEMHNSA-N -HMDB0001406 122.048012824 Niacinamide C6H6N2O DFPAKSUCGFBDDF-UHFFFAOYSA-N -HMDB0001414 88.100048394 Putrescine C4H12N2 KIDHWZJUCRJVML-UHFFFAOYSA-N -HMDB0001419 402.349780716 24-Hydroxycholesterol C27H46O2 IOWMKBFJCNLRTC-XWXSNNQWSA-N -HMDB0001429 97.976895096 Phosphate H3O4P NBIIXXVUZAFLBC-UHFFFAOYSA-N -HMDB0001431 168.089877638 Pyridoxamine C8H12N2O2 NHZMQXZHNVQTQA-UHFFFAOYSA-N -HMDB0001432 130.121846468 Agmatine C5H14N4 QYPPJABKJHAVHS-UHFFFAOYSA-N -HMDB0001448 97.967379242 Sulfate H2O4S QAOWNCQODCNURD-UHFFFAOYSA-N -HMDB0001453 57.975144695 Thiocyanate CNS ZMZDMBWJUHKJPS-UHFFFAOYSA-M -HMDB0001480 299.282429433 3-Dehydrosphinganine C18H37NO2 KBUNOSOGGAARKZ-KRWDZBQOSA-N -HMDB0001485 114.140850576 Octane C8H18 TVMXDCGIABBOFY-UHFFFAOYSA-N -HMDB0001488 123.032028409 "Nicotinic acid" C6H5NO2 PVNIIMVLHYAWGP-UHFFFAOYSA-N -HMDB0001492 416.36543078 Gamma-Tocopherol C28H48O2 QUEDXNHFTDJVIY-UHFFFAOYSA-N -HMDB0001496 402.349780716 7a-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-AWBHSAGMSA-N -HMDB0001505 78.046950192 Benzene C6H6 UHOVQNZJYSORNB-UHFFFAOYSA-N -HMDB0001514 179.079372531 Glucosamine C6H13NO5 MSWZFWKMSRAUBD-IVMDWMLBSA-N -HMDB0001520 456.104614802 "Flavin Mononucleotide" C17H21N4O9P FVTCRASFADXXNN-SCRDCRAPSA-N -HMDB0001522 73.063997239 Methylguanidine C2H7N3 CHJJGSNFBQVOTG-UHFFFAOYSA-N -HMDB0001527 120.02450019 "3-Methylthiopropionic acid" C4H8O2S CAOMCZAIALVUPA-UHFFFAOYSA-N -HMDB0001536 45.021463723 Formamide CH3NO ZHNUHDYFZUAESO-UHFFFAOYSA-N -HMDB0001539 202.14297584 "Asymmetric dimethylarginine" C8H18N4O2 YDGMGEXADBMOMJ-LURJTMIESA-N -HMDB0001545 167.058243159 Pyridoxal C8H9NO3 RADKZDMFGJYCBB-UHFFFAOYSA-N -HMDB0001548 230.01915384 "D-Ribose 5-phosphate" C5H11O8P KTVPXOYAKDPRHY-SOOFDHNKSA-N -HMDB0001563 297.107318615 1-Methylguanosine C11H15N5O5 UTAIYTHAJQNQDW-KQYNXXCUSA-N -HMDB0001565 184.073869485 Phosphorylcholine C5H15NO4P YHHSONZFOIEMCP-UHFFFAOYSA-O -HMDB0001569 388.370516158 Epi-coprostanol C27H48O QYIXCDOBOSTCEI-FBVYSKEZSA-N -HMDB0001624 132.07864425 "2-Hydroxycaproic acid" C6H12O3 NYHNVHGFPZAZGA-UHFFFAOYSA-N -HMDB0001644 150.05282343 D-Xylulose C5H10O5 ZAQJHHRNXZUBTE-WUJLRWPWSA-N -HMDB0001645 131.094628665 L-Norleucine C6H13NO2 LRQKBLKVPFOOQJ-YFKPBYRVSA-N -HMDB0001659 58.041864814 Acetone C3H6O CSCPPACGZOOCGX-UHFFFAOYSA-N -HMDB0001713 164.047344122 "m-Coumaric acid" C9H8O3 KKSDGJDHHZEWEP-SNAWJCMRSA-N -HMDB0001844 132.042258744 "Methylsuccinic acid" C5H8O4 WXUAQHNMJWJLTG-UHFFFAOYSA-N -HMDB0001847 194.080375584 Caffeine C8H10N4O2 RYYVLZVUVIJVGH-UHFFFAOYSA-N -HMDB0001851 152.068473494 L-Arabitol C5H12O5 HEBKCHPVOIAQTA-IMJSIDKUSA-N -HMDB0001856 154.026608673 "Protocatechuic acid" C7H6O4 YQUVCSBJEUQKSH-UHFFFAOYSA-N -HMDB0001857 196.059640142 "1,3-Dimethyluric acid" C7H8N4O3 OTSBKHHWSQYEHK-UHFFFAOYSA-N -HMDB0001858 108.057514878 p-Cresol C7H8O IWDCLRJOBJJRNH-UHFFFAOYSA-N -HMDB0001859 151.063328537 Acetaminophen C8H9NO2 RZVAJINKPMORJF-UHFFFAOYSA-N -HMDB0001860 180.06472552 Paraxanthine C7H8N4O2 QUNWUDVFRNGTCO-UHFFFAOYSA-N -HMDB0001863 118.062994186 "2-Hydroxyvaleric acid" C5H10O3 JRHWHSJDIILJAT-UHFFFAOYSA-N -HMDB0001867 194.069142196 "4-Aminohippuric acid" C9H10N2O3 HSMNQINEKMPTIC-UHFFFAOYSA-N -HMDB0001870 122.036779433 "Benzoic acid" C7H6O2 WPYMKLBDIGXBTP-UHFFFAOYSA-N -HMDB0001871 290.07903818 Epicatechin C15H14O6 PFTAWBLQPZVEMU-UKRRQHHQSA-N -HMDB0001873 88.0524295 "Isobutyric acid" C4H8O2 KQNPFQTWMSNSAP-UHFFFAOYSA-N -HMDB0001875 32.02621475 Methanol CH4O OKKJLVBELUTLKV-UHFFFAOYSA-N -HMDB0001881 76.0524295 "Propylene glycol" C3H8O2 DNIAPMSPPWPWGF-UHFFFAOYSA-N -HMDB0001882 90.031694058 Dihydroxyacetone C3H6O3 RXKJFZQQPQGTFL-UHFFFAOYSA-N -HMDB0001886 166.049075456 3-Methylxanthine C6H6N4O2 GMSNIKWWOQHZGF-UHFFFAOYSA-N -HMDB0001889 180.06472552 Theophylline C7H8N4O2 ZFXYFBGIUFBOJW-UHFFFAOYSA-N -HMDB0001890 163.030313849 Acetylcysteine C5H9NO3S PWKSKIMOESPYIA-BYPYZUCNSA-N -HMDB0001893 430.381080844 alpha-Tocopherol C29H50O2 GVJHHUAWPYXKBD-IEOSBIPESA-N -HMDB0001895 138.031694053 "Salicylic acid" C7H6O3 YGSDEFSMJLZEOE-UHFFFAOYSA-N -HMDB0001898 592.32608516 Mesobilirubinogen C33H44N4O6 OBHRVMZSZIDDEK-UHFFFAOYSA-N -HMDB0001901 131.094628665 "Aminocaproic acid" C6H13NO2 SLXKOJJOQWFEFD-UHFFFAOYSA-N -HMDB0001903 416.329045274 Calcitriol C27H44O3 GMRQFYUYWCNGIN-NKMMMXOESA-N -HMDB0001906 103.063328537 "2-Aminoisobutyric acid" C4H9NO2 FUOOLUPWFVMBKG-UHFFFAOYSA-N -HMDB0001921 129.101445377 1,1-Dimethylbiguanide C4H11N5 XZWYZXLIPXDOLR-UHFFFAOYSA-N -HMDB0001923 230.094294314 Naproxen C14H14O3 CMWTZPSULFXXJA-VIFPVBQESA-N -HMDB0001924 266.16304258 Atenolol C14H22N2O3 METKIMKYRPQLGS-UHFFFAOYSA-N -HMDB0001928 296.964474846 Hydrochlorothiazide C7H8ClN3O4S2 JZUFKLXOESDKRF-UHFFFAOYSA-N -HMDB0001929 361.143784348 Levofloxacin C18H20FN3O4 GSDSWSVVBLHKDQ-JTQLQIEISA-N -HMDB0001931 264.136159124 gamma-CEHC C15H20O4 VMJQLPNCUPGMNQ-UHFFFAOYSA-N -HMDB0001932 267.183443671 Metoprolol C15H25NO3 IUBSYMUCCVWXPE-UHFFFAOYSA-N -HMDB0001933 330.007719869 Furosemide C12H11ClN2O5S ZZUFCTLCJUWOSV-UHFFFAOYSA-N -HMDB0001940 253.107593387 Triamterene C12H11N7 FNYLWPVRPXGIIP-UHFFFAOYSA-N -HMDB0001943 165.115364107 Pseudoephedrine C10H15NO KWGRBVOPPLSCSI-WCBMZHEXSA-N -HMDB0001954 160.109944378 "3-Hydroxyoctanoic acid" C8H16O3 NDPLAKGOSZHTPH-UHFFFAOYSA-N -HMDB0001964 180.042258744 "Caffeic acid" C9H8O4 QAIPRVGONGVQAS-RQOWECAXSA-N -HMDB0001970 182.043990078 "3-Methyluric acid" C6H6N4O3 ODCYDGXXCHTFIR-UHFFFAOYSA-N -HMDB0001976 330.255880332 "Docosapentaenoic acid (22n-6)" C22H34O2 AVKOENOBFIYBSA-WMPRHZDHSA-N -HMDB0001982 196.059640142 "3,7-Dimethyluric acid" C7H8N4O3 HMLZLHKHNBLLJD-UHFFFAOYSA-N -HMDB0001988 144.07864425 "4-Hydroxycyclohexylcarboxylic acid" C7H12O3 HCFRWBBJISAZNK-UHFFFAOYSA-N -HMDB0001991 166.049075456 7-Methylxanthine C6H6N4O2 PFWLFWPASULGAN-UHFFFAOYSA-N -HMDB0001999 302.224580204 "Eicosapentaenoic acid" C20H30O2 JAZBEHYOTPTENJ-JLNKQSITSA-N -HMDB0002000 226.193280076 "Myristoleic acid" C14H26O2 YWWVWXASSLXJHU-WAYWQWQTSA-N -HMDB0002001 132.042258744 "Dimethylmalonic acid" C5H8O4 OREAFAJWWJHCOT-UHFFFAOYSA-N -HMDB0002003 368.36543078 "Tetracosanoic acid" C24H48O2 QZZGJDVWLFXDLK-UHFFFAOYSA-N -HMDB0002005 165.045963913 "Methionine sulfoxide" C5H11NO3S QEFRNWWLZKMPFJ-UHFFFAOYSA-N -HMDB0002013 231.14705816 Butyrylcarnitine C11H21NO4 QWYFHHGCZUCMBN-SECBINFHSA-N -HMDB0002017 121.089149357 1-Phenylethylamine C8H11N RQEUFEKYXDPUSK-UHFFFAOYSA-N -HMDB0002019 296.307915908 Phytol C20H40O BOTWFXYSPFMFNR-PYDDKJGSSA-N -HMDB0002024 126.042927446 "Imidazoleacetic acid" C5H6N2O2 PRJKNHOMHKJCEJ-UHFFFAOYSA-N -HMDB0002032 167.044324429 8-Hydroxyguanine C5H5N5O2 CLGFIVUFZRGQRP-UHFFFAOYSA-N -HMDB0002035 164.047344122 "4-Hydroxycinnamic acid" C9H8O3 NGSWKAQJJWESNS-ZZXKWVIFSA-N -HMDB0002048 108.057514878 m-Cresol C7H8O RLSSMJSEOOYNOY-UHFFFAOYSA-N -HMDB0002055 108.057514878 o-Cresol C7H8O QWVGKYWNOKOFNN-UHFFFAOYSA-N -HMDB0002064 130.11061308 N-Acetylputrescine C6H14N2O KLZGKIDSEJWEDW-UHFFFAOYSA-N -HMDB0002068 338.318480588 "Erucic acid" C22H42O2 DPUOLQHDNGRHBS-KTKRTIGZSA-N -HMDB0002085 198.052823422 "Syringic acid" C9H10O5 JMSVCTWVEWCHDZ-UHFFFAOYSA-N -HMDB0002088 325.298079497 N-Oleoylethanolamine C20H39NO2 BOWVQLFMWHZBEF-KTKRTIGZSA-N -HMDB0002098 488.174120354 2-Fucosyllactose C18H32O15 HWHQUWQCBPAQQH-BWRPKUOHSA-N -HMDB0002100 299.282429433 Palmitoylethanolamide C18H37NO2 HXYVTAGFYLMHSO-UHFFFAOYSA-N -HMDB0002107 166.02660868 "Phthalic acid" C8H6O4 XNGIFLGASWRNHJ-UHFFFAOYSA-N -HMDB0002108 135.035399227 Methylcysteine C4H9NO2S IDIDJDIHTAOVLG-VKHMYHEASA-N -HMDB0002117 281.271864747 Oleamide C18H35NO FATBGEAMYMYZAF-KTKRTIGZSA-N -HMDB0002123 210.075290206 "1,3,7-Trimethyluric acid" C8H10N4O3 BYXCFUMGEBZDDI-UHFFFAOYSA-N -HMDB0002124 270.05282343 Apigenin C15H10O5 KZNIFHPLKGYRTM-UHFFFAOYSA-N -HMDB0002142 97.976895096 "Phosphoric acid" H3O4P NBIIXXVUZAFLBC-UHFFFAOYSA-N -HMDB0002151 78.013935504 "Dimethyl sulfoxide" C2H6OS IAZDPXIOMUYVGZ-UHFFFAOYSA-N -HMDB0002166 103.063328537 "(S)-b-aminoisobutyric acid" C4H9NO2 QCHPKSFMDHPSNR-VKHMYHEASA-N -HMDB0002172 286.236876224 N1,N12-Diacetylspermine C14H30N4O2 NPDTUDWGJMBVEP-UHFFFAOYSA-N -HMDB0002176 102.068079564 "Ethylmethylacetic acid" C5H10O2 WLAMNBDJUVNPJU-UHFFFAOYSA-N -HMDB0002183 328.240230268 "Docosahexaenoic acid" C22H32O2 MBMBGCFOFBJSGT-KUBAVDMBSA-N -HMDB0002199 166.062994186 Desaminotyrosine C9H10O3 NMHMNPHRMNGLLB-UHFFFAOYSA-N -HMDB0002201 175.084457909 "N-Carboxyethyl-g-aminobutyric acid" C7H13NO4 SRGQUICKDUQCKO-UHFFFAOYSA-N -HMDB0002203 188.141244506 "3-Hydroxycapric acid" C10H20O3 FYSSBMZUBSBFJL-UHFFFAOYSA-N -HMDB0002212 312.302830524 "Arachidic acid" C20H40O2 VKOBVWXKNCXXDE-UHFFFAOYSA-N -HMDB0002226 332.271530396 "Adrenic acid" C22H36O2 TWSWSIQAPQLDBP-DOFZRALJSA-N -HMDB0002227 305.199093735 Capsaicin C18H27NO3 YKPUWZUDDOIDPM-SOFGYWHQSA-N -HMDB0002231 310.28718046 "11Z-Eicosenoic acid" C20H38O2 BITHHVVYSMSWAG-KTKRTIGZSA-N -HMDB0002243 123.032028409 "Picolinic acid" C6H5NO2 SIOXPEMLGUPBBT-UHFFFAOYSA-N -HMDB0002250 343.272258677 Dodecanoylcarnitine C19H37NO4 FUJLYHJROOYKRA-QGZVFWFLSA-N -HMDB0002259 270.255880332 "Heptadecanoic acid" C17H34O2 KEMQGTRYUADPNZ-UHFFFAOYSA-N -HMDB0002261 244.203844762 "2-Hydroxymyristic acid" C14H28O3 JYZJYKOZGGEXSX-UHFFFAOYSA-N -HMDB0002264 160.109944378 "(R)-2-Hydroxycaprylic acid" C8H16O3 JKRDADVRIYVCCY-SSDOTTSWSA-N -HMDB0002269 368.125988372 Curcumin C21H20O6 VFLDPWHFBUODDF-FCXRPNKRSA-N -HMDB0002271 140.05857751 "Imidazolepropionic acid" C6H8N2O2 ZCKYOWGFRHAZIQ-UHFFFAOYSA-N -HMDB0002284 144.126263144 N-Acetylcadaverine C7H16N2O RMOIHHAKNOFHOE-UHFFFAOYSA-N -HMDB0002299 103.063328537 "(R)-b-aminoisobutyric acid" C4H9NO2 QCHPKSFMDHPSNR-GSVOUGTGSA-N -HMDB0002302 189.078978601 "Indole-3-propionic acid" C11H11NO2 GOLXRNDWAUTYKT-UHFFFAOYSA-N -HMDB0002303 62.019020882 Dimethylsulfide C2H6S QMMFVYPAHWMCMS-UHFFFAOYSA-N -HMDB0002320 156.053492132 "Imidazolelactic acid" C6H8N2O3 JTYMXXCJQKGGFG-UHFFFAOYSA-N -HMDB0002322 102.115698458 Cadaverine C5H14N2 VHRGRCVQAFMJIZ-UHFFFAOYSA-N -HMDB0002327 244.167459256 "1,11-Undecanedicarboxylic acid" C13H24O4 DXNCZXXFRKPEPY-UHFFFAOYSA-N -HMDB0002329 89.995308552 "Oxalic acid" C2H2O4 MUBZPKHOEPUJKR-UHFFFAOYSA-N -HMDB0002340 136.0524295 "2-Methylbenzoic acid" C8H8O2 ZWLPBLYKEWSWPD-UHFFFAOYSA-N -HMDB0002349 142.02660868 "trans-trans-Muconic acid" C6H6O4 TXXHDPDFNKHHGW-ZPUQHVIOSA-N -HMDB0002350 270.292265838 Octadecanol C18H38O GLDOVTGHNKAZLK-UHFFFAOYSA-N -HMDB0002361 382.381080844 "Pentacosanoic acid" C25H50O2 MWMPEAHGUXCSMY-UHFFFAOYSA-N -HMDB0002362 118.074227574 "2,4-Diaminobutyric acid" C4H10N2O2 OGNSCSPNOLGXSM-UHFFFAOYSA-N -HMDB0002364 456.360345406 "Oleanolic acid" C30H48O3 MIJYXULNPSFWEK-GTOFXWBISA-N -HMDB0002366 243.14705816 Tiglylcarnitine C12H21NO4 WURBQCVBQNMUQT-OLKPEBQYSA-N -HMDB0002368 366.349780716 "Nervonic acid" C24H46O2 GWHCXVQVJPWHRF-KTKRTIGZSA-N -HMDB0002372 283.120843415 N-Phenylacetylphenylalanine C17H17NO3 LIIPHJDKZNTNII-HNNXBMFYSA-N -HMDB0002384 268.276615774 Stearaldehyde C18H36O FWWQKRXKHIRPJY-UHFFFAOYSA-N -HMDB0002390 152.047344122 "3-Cresotinic acid" C8H8O3 WHSXTWFYRGOBGO-UHFFFAOYSA-N -HMDB0002395 456.360345406 "Ursolic acid" C30H48O3 WCGUUGGRBIKTOS-GPOJBZKASA-N -HMDB0002409 529.270938047 N-[(3a,5b,7b)-7-hydroxy-24-oxo-3-(sulfooxy)cholan-24-yl]-Glycine C26H43NO8S DKXXSIJHWWVNMO-XROMFQGDSA-N -HMDB0002432 142.02660868 "Sumiki's acid" C6H6O4 PCSKKIUURRTAEM-UHFFFAOYSA-N -HMDB0002466 138.031694053 "3-Hydroxybenzoic acid" C7H6O3 IJFXRHURBJZNAO-UHFFFAOYSA-N -HMDB0002504 458.23382426 "3-Sulfodeoxycholic acid" C23H38O7S WSBVSABEAXNERB-JNLBVXOESA-N -HMDB0002520 172.013674532 "Beta-Glycerophosphoric acid" C3H9O6P DHCLVCXQIBBOPH-UHFFFAOYSA-N -HMDB0002536 392.292659768 "Isodeoxycholic acid" C24H40O4 ZHCAAZIHTDCFJX-QLEQUTGBSA-N -HMDB0002545 194.042652674 "Galacturonic acid" C6H10O7 IAJILQKETJEXLJ-RSJOWCBRSA-N -HMDB0002580 563.258658801 "Taurolithocholic acid 3-sulfate" C26H45NO8S2 HSNPMXROZIQAQD-GBURMNQMSA-N -HMDB0002586 472.249474324 "Chenodeoxycholic acid 3-sulfate" C24H40O7S WHMOBEGYTDWMIG-BSWAIDMHSA-N -HMDB0002639 513.276023425 Sulfolithocholylglycine C26H43NO7S FHXBAFXQVZOILS-JWOIRZCRSA-N -HMDB0002642 472.249474324 "Ursodeoxycholic acid 3-sulfate" C24H40O7S WHMOBEGYTDWMIG-ROKSHQGPSA-N -HMDB0002658 139.026943031 "6-Hydroxynicotinic acid" C6H5NO3 BLHCMGRVFXRYRN-UHFFFAOYSA-N -HMDB0002670 272.068473494 Naringenin C15H12O5 FTVWIRXFELQLPI-ZDUSSCGKSA-N -HMDB0002685 356.256274262 "Prostaglandin F1a" C20H36O5 DZUXGQBLFALXCR-CDIPTNKSSA-N -HMDB0002714 16.031300128 Methane CH4 VNWKTOKETHGBQD-UHFFFAOYSA-N -HMDB0002759 370.18139476 "Androsterone sulfate" C19H30O5S ZMITXKRGXGRMKS-HLUDHZFRSA-N -HMDB0002780 290.07903818 Catechin C15H14O6 PFTAWBLQPZVEMU-DZGCQCFKSA-N -HMDB0002815 521.348139535 LysoPC(18:1(9Z)) C26H52NO7P YAMUFBLWGFFICM-PTGWMXDISA-N -HMDB0002820 140.05857751 "Methylimidazoleacetic acid" C6H8N2O2 ZHCKPJGJQOPTLB-UHFFFAOYSA-N -HMDB0002823 334.28718046 "Docosatrienoic acid" C22H38O2 WBBQTNCISCKUMU-PDBXOOCHSA-N -HMDB0002825 180.06472552 Theobromine C7H8N4O2 YAPQBXQYLJRXSA-UHFFFAOYSA-N -HMDB0002869 400.370516166 Campesterol C28H48O SGNBVLSWZMBQTH-PODYLUTMSA-N -HMDB0002902 402.349780716 Delta-Tocopherol C27H46O2 GZIFEOYASATJEH-VHFRWLAGSA-N -HMDB0002917 152.068473494 D-Xylitol C5H12O5 HEBKCHPVOIAQTA-NGQZWQHPSA-N -HMDB0002925 306.255880332 "8,11,14-Eicosatrienoic acid" C20H34O2 HOBAELRKJCKHQD-QNEBEIHSSA-N -HMDB0002931 147.053157781 N-Acetylserine C5H9NO4 JJIHLJJYMXLCOY-BYPYZUCNSA-N -HMDB0002939 100.088815006 "Methyl isobutyl ketone" C6H12O NTIZESTWPVYFNL-UHFFFAOYSA-N -HMDB0002985 260.029718526 "Inositol phosphate" C6H13O9P INAPMGSXUVUWAF-XCMZKKERSA-N -HMDB0002994 122.057908808 Erythritol C4H10O4 UNXHWFMMPAWVPI-ZXZARUISSA-N -HMDB0003072 192.063388116 "Quinic acid" C7H12O6 AAWZDTNXLSGCEK-RKGSPJAZSA-N -HMDB0003073 278.224580204 "Gamma-Linolenic acid" C18H30O2 VZCCETWTMQHEPK-QNEBEIHSSA-N -HMDB0003099 182.043990078 "1-Methyluric acid" C6H6N4O3 QFDRTQONISXGJA-UHFFFAOYSA-N -HMDB0003119 108.057514878 "Benzyl alcohol" C7H8O WVDDGKGOMKODPV-UHFFFAOYSA-N -HMDB0003156 90.068079564 2,3-Butanediol C4H10O2 OWBTYPJTUOEWEK-UHFFFAOYSA-N -HMDB0003157 175.059305791 "Guanidinosuccinic acid" C5H9N3O4 VVHOUVWJCQOYGG-REOHCLBHSA-N -HMDB0003178 616.177297665 Heme C34H32FeN4O4 KABFMIBPWCXCRK-RGGAHWMASA-L -HMDB0003213 504.169034976 Raffinose C18H32O16 MUPFEKGTMRGPLJ-BQCSWRFHSA-N -HMDB0003217 270.052823422 Genistein C15H10O5 TZBJGXHYKVUXJN-UHFFFAOYSA-N -HMDB0003224 134.057908808 Deoxyribose C5H10O4 PDWIQYODPROSQH-WISUUJSJSA-N -HMDB0003227 48.003370818 Methanethiol CH4S LSDPWZHWYPCBBB-UHFFFAOYSA-N -HMDB0003229 254.224580204 "Palmitoleic acid" C16H30O2 SECPZKHBENQXJG-FPLPWBNLSA-N -HMDB0003231 282.255880335 "Vaccenic acid" C18H34O2 UWHZIFQPPBDJPM-BQYQJAHWSA-N -HMDB0003236 397.334465003 Solanidine C27H43NO JVKYZPBMZPJNAJ-OQFNDJACSA-N -HMDB0003243 88.0524295 Acetoin C4H8O2 ROWKJAVDOGWPAT-UHFFFAOYSA-N -HMDB0003265 610.189770418 Hesperidin C28H34O15 QUQPHWDTPGMPEX-UNZJSITISA-N -HMDB0003276 33.987720754 "Hydrogen sulfide" H2S RWSOTUBLDIXVET-UHFFFAOYSA-N -HMDB0003290 196.058302738 "Gulonic acid" C6H12O7 RGHNJXZEOKUKBD-KKQCNMDGSA-N -HMDB0003312 254.057908802 Daidzein C15H10O4 ZQSIJRDFPHDXIC-UHFFFAOYSA-N -HMDB0003315 98.073164942 Cyclohexanone C6H10O JHIVVAPYMSGYDF-UHFFFAOYSA-N -HMDB0003320 161.047678473 "Indole-3-carboxylic acid" C9H7NO2 KMAKOBLIOCQGJP-UHFFFAOYSA-N -HMDB0003331 281.112403993 1-Methyladenosine C11H15N5O4 GFYLSDSUCHVORB-IOSLPCCCSA-N -HMDB0003334 202.14297584 "Symmetric dimethylarginine" C8H18N4O2 HVPFXCBJHIIJGS-LURJTMIESA-N -HMDB0003339 147.053157781 "D-Glutamic acid" C5H9NO4 WHUUTDBJXJRKMK-GSVOUGTGSA-N -HMDB0003345 180.063388116 Alpha-D-Glucose C6H12O6 WQZGKKKJIJFFOK-DVKNGEFBSA-N -HMDB0003349 158.03275669 "L-Dihydroorotic acid" C5H6N2O4 UFIVEPVSAGBUSI-REOHCLBHSA-N -HMDB0003352 156.151415264 Menthol C10H20O NOOLISFMXDJSKH-KXUCPTDWSA-N -HMDB0003355 117.078978601 "5-Aminopentanoic acid" C5H11NO2 JJMDCOVWQOJGCB-UHFFFAOYSA-N -HMDB0003357 174.100442324 N-Acetylornithine C7H14N2O3 JRLGPAXAGHMNOL-LURJTMIESA-N -HMDB0003361 80.037448138 Pyrimidine C4H4N2 CZPWVGJYEJSRLH-UHFFFAOYSA-N -HMDB0003363 194.042652674 "Pectic acid" C6H10O7 AEMOLEFTQBMNLQ-BKBMJHBISA-N -HMDB0003366 58.041864814 Propanal C3H6O NBBJYMSMWIIQGU-UHFFFAOYSA-N -HMDB0003371 150.05282343 L-Ribulose C5H10O5 LQXVFWRQNMEDEE-OVEKKEMJSA-N -HMDB0003374 132.089877638 D-Ornithine C5H12N2O2 AHLPHDHHMVZTML-SCSAIBSYSA-N -HMDB0003375 136.125200512 D-Limonene C10H16 XMGQYMWWDOXHJM-SNVBAGLBSA-N -HMDB0003405 146.105527702 D-Lysine C6H14N2O2 KDXKERNSBIXSRK-YFKPBYRVSA-N -HMDB0003407 86.036779436 Diacetyl C4H6O2 QSJXEFYPDANLFS-UHFFFAOYSA-N -HMDB0003424 242.26096571 1-Hexadecanol C16H34O BXWNKGSJHAJOGX-UHFFFAOYSA-N -HMDB0003441 132.057514878 Cinnamaldehyde C9H8O KJPRLNWUNMBNBZ-QPJJXVBHSA-N -HMDB0003449 180.063388116 Beta-D-Galactose C6H12O6 WQZGKKKJIJFFOK-FPRJBGLDSA-N -HMDB0003464 145.085126611 "4-Guanidinobutanoic acid" C5H11N3O2 TUHVEAJXIMEOSA-UHFFFAOYSA-N -HMDB0003466 178.047738052 L-Gulonolactone C6H10O6 SXZYCXMUPBBULW-SKNVOMKLSA-N -HMDB0003518 206.042652674 "Homocitric acid" C7H10O7 XKJVEVRQMLKSMO-SSDOTTSWSA-N -HMDB0003543 72.057514878 Butanal C4H8O ZTQSAGDEMFDKMZ-UHFFFAOYSA-N -HMDB0003603 540.490631292 CE(10:0) C37H64O2 LJGMGXXCKVFFIS-UHFFFAOYSA-N -HMDB0003646 114.042927446 N-Methylhydantoin C4H6N2O2 RHYBFKMFHLPQPH-UHFFFAOYSA-N -HMDB0003671 114.10446507 2-Heptanone C7H14O CATSNJVOTSVZJV-UHFFFAOYSA-N -HMDB0003681 145.073893223 "4-Acetamidobutanoic acid" C6H11NO3 UZTFMUBKZQVKLK-UHFFFAOYSA-N -HMDB0003818 290.224580204 5-Androstenediol C19H30O2 QADHLRWLCPCEKT-LOVVWNRFSA-N -HMDB0003843 114.068079564 Gamma-Caprolactone C6H10O2 JBFHTYHTHYHCDJ-UHFFFAOYSA-N -HMDB0003869 275.148120797 Epsilon-(gamma-Glutamyl)-lysine C11H21N3O5 JPKNLFVGUZRHOB-YUMQZZPRSA-N -HMDB0003911 103.063328537 "3-Aminoisobutanoic acid" C4H9NO2 QCHPKSFMDHPSNR-UHFFFAOYSA-N -HMDB0003990 420.360345402 3b,5a,6b-Cholestanetriol C27H48O3 YMMFNKXZULYSOQ-RUXQDQFYSA-N -HMDB0004041 119.058243159 L-Allothreonine C4H9NO3 AYFVYJQAPQTCCC-HRFVKAFMSA-N -HMDB0004043 154.135765198 Alpha-Terpineol C10H18O WUOACPNHFRMFPN-VIFPVBQESA-N -HMDB0004044 281.112403993 N6-Methyladenosine C11H15N5O4 VQAYFKKCNSOZKM-IOSLPCCCSA-N -HMDB0004067 195.053157781 Leucodopachrome C9H9NO4 JDWYRSDDJVCWPB-LURJTMIESA-N -HMDB0004073 175.063328537 5-Hydroxyindoleacetaldehyde C10H9NO2 OBFAPCIUSYHFIE-UHFFFAOYSA-N -HMDB0004077 161.047678473 4,6-Dihydroxyquinoline C9H7NO2 XFALURCRIGINGT-UHFFFAOYSA-N -HMDB0004083 223.048072403 "4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid" C10H9NO5 YCJNYHCCOXVYAF-UHFFFAOYSA-N -HMDB0004096 205.073893223 5-Methoxyindoleacetate C11H11NO3 COCNDHOPIHDTHK-UHFFFAOYSA-N -HMDB0004136 122.057908808 D-Threitol C4H10O4 UNXHWFMMPAWVPI-QWWZWVQMSA-N -HMDB0004157 596.357385288 L-Urobilinogen C33H48N4O6 VKGRRZVYCXLHII-UHFFFAOYSA-N -HMDB0004158 590.310435096 D-Urobilinogen C33H42N4O6 KSQFFJKKJAEKTB-UHFFFAOYSA-N -HMDB0004159 594.341735224 L-Urobilin C33H46N4O6 TYOWQSLRVAUSMI-WKULSOCRSA-N -HMDB0004161 588.294785032 D-Urobilin C33H40N4O6 DOKCNDVEPDZOJQ-MBTHVWNTSA-N -HMDB0004193 152.05857751 N1-Methyl-2-pyridone-5-carboxamide C7H8N2O2 JLQSXXWTCJPCBC-UHFFFAOYSA-N -HMDB0004207 275.148120797 Glutamyllysine C11H21N3O5 BBBXWRGITSUJPB-YUMQZZPRSA-N -HMDB0004230 111.032028409 "Pyrrole-2-carboxylic acid" C5H5NO2 WRHZVMBBRYBTKZ-UHFFFAOYSA-N -HMDB0004231 205.131408101 Pantothenol C9H19NO4 SNPLKNRPJHDVJA-UHFFFAOYSA-N -HMDB0004259 264.11100701 Acetyl-N-formyl-5-methoxykynurenamine C13H16N2O4 JYWNYMJKURVPFH-UHFFFAOYSA-N -HMDB0004284 138.068079564 Tyrosol C8H10O2 YCCILVSKPBXVIP-UHFFFAOYSA-N -HMDB0004327 74.073164942 1-Butanol C4H10O LRHPLDYGYMQRHN-UHFFFAOYSA-N -HMDB0004362 156.115029756 4-Hydroxynonenal C9H16O2 JVJFIQYAHPMBBX-FNORWQNLSA-N -HMDB0004400 198.075290206 5-Acetylamino-6-amino-3-methyluracil C7H10N4O3 POQOTWQIYYNXAT-UHFFFAOYSA-N -HMDB0004472 154.1357652 Eucalyptol C10H18O WEEGYLXZBRQIMU-UHFFFAOYSA-N -HMDB0004610 317.292994119 Phytosphingosine C18H39NO3 AERBNCYCJBRYDG-KSZLIROESA-N -HMDB0004620 216.122240398 N-a-Acetyl-L-arginine C8H16N4O3 SNEIUMQYRCDYCH-LURJTMIESA-N -HMDB0004666 378.277009704 2-Arachidonylglycerol C23H38O4 RCRCTBLIHCHWDZ-DOFZRALJSA-N -HMDB0004704 314.245709576 9,10-DHOME C18H34O4 XEBKSQSGNGRGDW-YFHOEESVSA-N -HMDB0004705 314.245709576 12,13-DHOME C18H34O4 CQSLTKIXAJTQGA-FLIBITNWSA-N -HMDB0004814 114.10446507 4-Heptanone C7H14O HCFAJYNVAYBARA-UHFFFAOYSA-N -HMDB0004827 143.094628665 "Proline betaine" C7H13NO2 CMUNUTVVOOHQPW-LURJTMIESA-N -HMDB0004844 1152.7131584 "Ganglioside GM3 (d18:1/16:0)" C57H104N2O21 NURCPIMQAUMKKZ-FZOQRHEPSA-N -HMDB0004848 1262.822708848 "Ganglioside GM3 (d18:1/24:1(15Z))" C65H118N2O21 BGMMKNTYKZAIDF-DJCHRBTISA-N -HMDB0004872 971.727292323 "Lactosylceramide (d18:1/24:1(15Z))" C54H101NO13 MKOKWBRPIBQYJJ-LWQSSKHKSA-N -HMDB0004947 481.449494759 "Ceramide (d18:1/12:0)" C30H59NO3 HXFPPRPLRSPNIB-VARSQMIESA-N -HMDB0004948 563.527745079 "Ceramide (d18:1/9Z-18:1)" C36H69NO3 OBFSLMQLPNKVRW-RHPAUOISSA-N -HMDB0004949 537.512095015 "Ceramide (d18:1/16:0)" C34H67NO3 YDNKGFDKKRUKPY-TURZORIXSA-N -HMDB0004950 565.543395143 "Ceramide (d18:1/18:0)" C36H71NO3 VODZWWMEJITOND-NXCSZAMKSA-N -HMDB0004951 593.574695271 "Ceramide (d18:1/20:0)" C38H75NO3 XWBWIAOWSABHFI-NUKVNZTCSA-N -HMDB0004952 621.605995399 "Ceramide (d18:1/22:0)" C40H79NO3 KEPQASGDXIEOIL-GLQCRSEXSA-N -HMDB0004953 647.621645463 Cer(d18:1/24:1(15Z)) C42H81NO3 VJSBNBBOSZJDKB-KPEYJIHVSA-N -HMDB0004955 677.668595655 Cer(d18:1/26:0) C44H87NO3 CJROVRTUSFQVMR-GVOPMEMSSA-N -HMDB0004956 649.637295527 "Ceramide (d18:1/24:0)" C42H83NO3 ZJVVOYPTFQEGPH-AUTSUKAISA-N -HMDB0004957 663.652945591 "Ceramide (d18:1/25:0)" C43H85NO3 QHPYSHVSWAOLHS-PVNBSDFKSA-N -HMDB0004971 699.564918445 "Glucosylceramide (d18:1/16:0)" C40H77NO8 VJLLLMIZEJJZTE-NNTBDIJYSA-N -HMDB0004972 727.596218573 "Glucosylceramide (d18:1/18:0)" C42H81NO8 YMYQEDCYNANIPI-DYJXBSQNSA-N -HMDB0004973 755.627518701 "Glucosylceramide (d18:1/20:0)" C44H85NO8 DFELABABMXOKTD-IYFIADHGSA-N -HMDB0004974 783.658818829 "Glucosylceramide (d18:1/22:0)" C46H89NO8 YIGARKIIFOHVPF-CNUVFPMCSA-N -HMDB0004975 809.674468893 "Glucosylceramide (d18:1/24:1(15Z))" C48H91NO8 WBOZIXHPUPAOIA-JZZPSRGZSA-N -HMDB0004977 839.721419085 "Glucosylceramide (d18:1/26:0)" C50H97NO8 DOIOUJPHIXRQFM-WBOUPBNQSA-N -HMDB0004978 811.690118957 "Glucosylceramide (d18:1/24:0)" C48H93NO8 POQRWMRXUOPCLD-AAAFHMTMSA-N -HMDB0004979 825.705769021 "Glucosylceramide (d18:1/25:0)" C49H95NO8 RIGGIBNQNREJCL-ZVFXBQQRSA-N -HMDB0004987 261.132470733 Aspartyllysine C10H19N3O5 OAMLVOVXNKILLQ-BQBZGAKWSA-N -HMDB0004989 137.084063979 m-Tyramine C8H11NO GHFGJTVYMNRGBY-UHFFFAOYSA-N -HMDB0004995 299.152143543 Codeine C18H21NO3 OROGSEYTTFOCAN-DNJOTXNNSA-N -HMDB0005006 558.253000445 Atorvastatin C33H35FN2O5 XUKUURHRXDUEBC-KAYWLYCHSA-N -HMDB0005015 171.125928793 Gabapentin C9H17NO2 UGJMXCAKCUNAIE-UHFFFAOYSA-N -HMDB0005028 324.163791509 Escitalopram C20H21FN2O WSEQXVZVJXJVFP-FQEVSTJZSA-N -HMDB0005030 501.287908741 Fexofenadine C32H39NO4 RWTNPBWLLIMQHL-UHFFFAOYSA-N -HMDB0005056 302.151809192 Enterodiol C18H22O4 DWONJCNDULPHLV-HOTGVXAUSA-N -HMDB0005060 308.271530396 "Eicosadienoic acid" C20H36O2 XSXIVVZCUAHUJO-HZJYTTRNSA-N -HMDB0005065 425.350508997 Oleoylcarnitine C25H47NO4 IPOLTUVFXFHAHI-WHIOSMTNSA-N -HMDB0005066 371.303558805 Tetradecanoylcarnitine C21H41NO4 PSHXNVGSVNEJBD-LJQANCHMSA-N -HMDB0005189 650.60018174 CE(18:1(11Z)) C45H78O2 BNQAKMBVXYXXED-XZMNDPPTSA-N -HMDB0005199 179.094628665 (R)-Salsolinol C10H13NO2 IBRKLUSXDYATLG-UHFFFAOYSA-N -HMDB0005357 834.767641004 TG(16:0/16:0/18:0) C53H102O6 DQKMNCLZNGAXNX-DPDRHGIRSA-N -HMDB0005360 832.75199094 TG(16:0/16:0/18:1(9Z)) C53H100O6 YHMDGPZOSGBQRH-OIVKDUIRSA-N -HMDB0005365 862.798941133 TG(16:0/18:0/18:0) C55H106O6 SDNYRTVJOFMYIW-MPLRIKRWSA-N -HMDB0005367 860.783291069 TG(16:0/18:0/18:1(9Z)) C55H104O6 NPCZZYKITFKRQZ-GUSWDXMPSA-N -HMDB0005368 888.814591198 TG(16:0/18:0/20:1(11Z)) C57H108O6 AOSKWYIWKDMXST-SEDDCBKKSA-N -HMDB0005370 882.767641004 TG(16:0/18:0/20:4(5Z,8Z,11Z,14Z)) C57H102O6 IBSUTTNKAUSOHR-WPQPACDXSA-N -HMDB0005372 916.845891326 TG(16:0/20:0/20:1(11Z)) C59H112O6 XRKBRKZCVJSDIQ-WOGGMIHASA-N -HMDB0005380 852.720690811 TG(16:0/16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C55H96O6 BURBQZUNMNAKMA-RAKRAUFVSA-N -HMDB0005381 888.814591198 TG(16:0/18:1(9Z)/20:0) C57H108O6 YWKYRFUPKVVPAH-IBZYRLJDSA-N -HMDB0005382 858.767641004 TG(16:0/18:1(9Z)/18:1(9Z)) C55H102O6 JFISYPWOVQNHLS-HMOYFKASSA-N -HMDB0005384 856.75199094 TG(16:0/18:1(9Z)/18:2(9Z,12Z)) C55H100O6 KGLAHZTWGPHKFF-OCHJDYJZSA-N -HMDB0005385 880.75199094 TG(16:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C57H100O6 KKABVOCYVJCRKP-LFLUISAQSA-N -HMDB0005386 914.830241262 TG(16:0/20:1(11Z)/20:1(11Z)) C59H110O6 OJBGBKUEIBXOEG-HLWAOEQNSA-N -HMDB0005389 884.783291069 TG(16:0/18:2(9Z,12Z)/20:1(11Z)) C57H104O6 YZEDZPDPXZLZNB-ZWFWDJCYSA-N -HMDB0005393 890.830241252 TG(18:0/18:0/18:0) C57H110O6 DCXXMTOCNZCJGO-UHFFFAOYSA-N -HMDB0005394 918.861541391 TG(18:0/18:0/20:0) C59H114O6 JFGIMQPGGNOOHN-UWGNJQTFSA-N -HMDB0005395 888.814591198 TG(18:0/18:0/18:1(9Z)) C57H108O6 YFFIQXNTTVSKJC-JRTFMWKKSA-N -HMDB0005396 916.845891326 TG(18:0/18:0/20:1(11Z)) C59H112O6 XCJBYQXUCQJPCZ-YLMVGIRGSA-N -HMDB0005401 938.830241262 TG(18:0/20:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 CCKRHDUCFMOBKX-QZCMQHALSA-N -HMDB0005402 916.845891326 TG(18:0/18:1(9Z)/20:0) C59H112O6 OCYFAHIHWCVZKS-APPANRPNSA-N -HMDB0005404 914.830241262 TG(18:0/18:1(9Z)/20:1(11Z)) C59H110O6 OWMDNFFJJVRJMG-NPFPARCISA-N -HMDB0005405 884.783291069 TG(18:0/18:1(9Z)/18:2(9Z,12Z)) C57H104O6 CNGSOZKJBWHOEG-XSLCMLJKSA-N -HMDB0005407 942.861541391 TG(18:0/20:1(11Z)/20:1(11Z)) C61H114O6 AFFQVAIMWFYJJS-WSWCACAZSA-N -HMDB0005409 914.830241262 TG(18:0/18:2(9Z,12Z)/20:0) C59H110O6 PDEQUPGHMOMBFC-MYJCFCEBSA-N -HMDB0005411 882.767641004 TG(18:0/18:2(9Z,12Z)/18:2(9Z,12Z)) C57H102O6 PJHDLKOEJMDTBE-YWDBEOBSSA-N -HMDB0005415 972.908491584 TG(20:0/20:0/20:1(11Z)) C63H120O6 YNDXXWKSWMKVGO-UGLYWXKVSA-N -HMDB0005416 966.861541391 TG(20:0/20:0/20:4(5Z,8Z,11Z,14Z)) C63H114O6 PORGMKLTIBAGKT-OFOBRNGWSA-N -HMDB0005418 970.89284152 TG(20:0/20:1(11Z)/20:1(11Z)) C63H118O6 QPNVLDQSHXVPMG-XBDORNQTSA-N -HMDB0005419 964.845891326 TG(20:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H112O6 VRTWSWFWQKBUDP-ZWVRCNAISA-N -HMDB0005420 958.798941133 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 ZZUYNPSYAPCHJT-YUPTWLKPSA-N -HMDB0005422 888.814591198 TG(16:1(9Z)/18:0/20:0) C57H108O6 UTGDZOIOODXGAH-XVDGJACESA-N -HMDB0005425 856.75199094 TG(16:1(9Z)/18:0/18:2(9Z,12Z)) C55H100O6 HLYOUKKBNQIMLH-WJGOVXLHSA-N -HMDB0005426 880.75199094 TG(16:1(9Z)/18:0/20:4(5Z,8Z,11Z,14Z)) C57H100O6 ITWBZDOMDJKFCH-YDOBIKPESA-N -HMDB0005427 916.845891326 TG(16:1(9Z)/20:0/20:0) C59H112O6 KJVYOEKCDNOOAP-HDIOEILJSA-N -HMDB0005428 914.830241262 TG(16:1(9Z)/20:0/20:1(11Z)) C59H110O6 XOCUQHRPEPNSJE-VFBDGFDBSA-N -HMDB0005432 800.689390676 TG(16:1(9Z)/16:1(9Z)/16:1(9Z)) C51H92O6 SKGWNZXOCSYJQL-BUTYCLJRSA-N -HMDB0005434 856.75199094 TG(16:1(9Z)/16:1(9Z)/20:1(11Z)) C55H100O6 YCIPIGLQWOQUJK-GJRCKUEISA-N -HMDB0005435 826.705040747 TG(16:1(9Z)/16:1(9Z)/18:2(9Z,12Z)) C53H94O6 PVMBAGXWHHZKFP-UMJFRGJPSA-N -HMDB0005438 856.75199094 TG(16:1(9Z)/18:1(9Z)/18:1(9Z)) C55H100O6 YBWITEZBUYUNFC-JZBMGIQCSA-N -HMDB0005439 884.783291069 TG(16:1(9Z)/18:1(9Z)/20:1(11Z)) C57H104O6 OVEMPQUFJMCLKI-XYSPBAOWSA-N -HMDB0005440 854.736340876 TG(16:1(9Z)/18:1(9Z)/18:2(9Z,12Z)) C55H98O6 WHSWXEYWNPTUPW-JRKROUSYSA-N -HMDB0005444 884.783291069 TG(16:1(9Z)/18:2(9Z,12Z)/20:0) C57H104O6 MSQBYCWSXAUJHK-YNOLVQETSA-N -HMDB0005445 882.767641004 TG(16:1(9Z)/18:2(9Z,12Z)/20:1(11Z)) C57H102O6 SZYBCITYDACFEY-DPJFVPNFSA-N -HMDB0005446 852.720690811 TG(16:1(9Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C55H96O6 CQZAAIKPSLHIBC-CUQDGRJASA-N -HMDB0005448 900.720690811 TG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 RXIRNQZZDMHWHR-QKSWABPTSA-N -HMDB0005450 942.861541391 TG(18:1(9Z)/20:0/20:1(11Z)) C61H114O6 QEBMDFMPVYJRFG-MAGLTKJYSA-N -HMDB0005452 914.830241262 TG(18:1(9Z)/18:1(9Z)/20:0) C59H110O6 JFKGKULDMWLHEK-REBZZEHGSA-N -HMDB0005454 912.814591198 TG(18:1(9Z)/18:1(9Z)/20:1(11Z)) C59H108O6 QXMHHXQBBKDSSL-QGDSHWIZSA-N -HMDB0005455 882.767641004 TG(18:1(9Z)/18:1(9Z)/18:2(9Z,12Z)) C57H102O6 JTMWOTXEVWLTTO-VYOWPWJFSA-N -HMDB0005457 940.845891326 TG(18:1(9Z)/20:1(11Z)/20:1(11Z)) C61H112O6 RFMSTHTUAZETPD-ONCGWXHTSA-N -HMDB0005460 910.798941133 TG(18:1(9Z)/18:2(9Z,12Z)/20:1(11Z)) C59H106O6 YONCDTJKIZDSKQ-UVIGLXQBSA-N -HMDB0005461 880.75199094 TG(18:1(9Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C57H100O6 VVEBTVMJPTZDHO-FVLXJHNRSA-N -HMDB0005464 968.877191444 TG(20:1(11Z)/20:1(11Z)/20:1(11Z)) C63H116O6 XKXYLRHFXANGHG-IUPFWZBJSA-N -HMDB0005465 962.830241262 TG(20:1(11Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 GGNMBNAJWKYLBB-WODJHLBGSA-N -HMDB0005466 956.783291069 TG(20:1(11Z)/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 BZPDQOHIKFKCEV-PDSJDQCGSA-N -HMDB0005467 942.861541391 TG(18:2(9Z,12Z)/20:0/20:0) C61H114O6 VYGDFJHLNCSFJZ-BBSNEIHHSA-N -HMDB0005468 940.845891326 TG(18:2(9Z,12Z)/20:0/20:1(11Z)) C61H112O6 WYUNJFXMLHILJN-PXGVGEJDSA-N -HMDB0005470 938.830241262 TG(18:2(9Z,12Z)/20:1(11Z)/20:1(11Z)) C61H110O6 OYDPSWDUKLRDNF-QAYHTBTLSA-N -HMDB0005474 878.736340868 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C57H98O6 HBOQXIRUPVQLKX-BBWANDEASA-N -HMDB0005476 926.736340876 TG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C61H98O6 GXWBCAVCOMAOHT-JRBFJTAESA-N -HMDB0005781 284.068473486 Glycitein C16H12O5 DXYUAIFZCFRPTH-UHFFFAOYSA-N -HMDB0005782 302.07903818 Hesperetin C16H14O6 AIONOLUJZLIMTK-AWEZNQCLSA-N -HMDB0005784 154.062994186 Hydroxytyrosol C8H10O3 JUUBCHWRXWPFFH-UHFFFAOYSA-N -HMDB0005800 286.047738052 Luteolin C15H10O6 IQPNAANSBPBGFQ-UHFFFAOYSA-N -HMDB0005801 286.047738052 Kaempferol C15H10O6 IYRMWMYZSQPJKC-UHFFFAOYSA-N -HMDB0005806 136.125200515 Gamma-terpinene C10H16 YKFLAYDHMOASIY-UHFFFAOYSA-N -HMDB0005807 170.021523293 "Gallic acid" C7H6O5 LNTHITQWFMADLM-UHFFFAOYSA-N -HMDB0005810 288.063388116 Eriodictyol C15H12O6 SBHXYTNGIZCORC-ZDUSSCGKSA-N -HMDB0005812 154.1357652 Geraniol C10H18O GLZPCOQZEFWAFX-YFHOEESVSA-N -HMDB0005841 114.10446507 "Ethyl isobutyl ketone" C7H14O DXVYLFHTJZWTRF-UHFFFAOYSA-N -HMDB0005842 100.088815006 2-Oxohexane C6H12O QQZOPKMRPOGIEB-UHFFFAOYSA-N -HMDB0005843 99.014269855 "Allyl isothiocyanate" C4H5NS ZOJBYZNEUISWFT-UHFFFAOYSA-N -HMDB0005846 100.088815006 "Ethyl isopropyl ketone" C6H12O HYTRYEXINDDXJK-UHFFFAOYSA-N -HMDB0005879 93.991091572 Dimethyldisulfide C2H6S2 WQOXQRCZOLPYPM-UHFFFAOYSA-N -HMDB0005994 100.088815006 Hexanal C6H12O JARKCYVAAOWBJS-UHFFFAOYSA-N -HMDB0006006 74.073164942 Isobutanol C4H10O ZXEKIIBDNHEJCQ-UHFFFAOYSA-N -HMDB0006007 88.088815006 Isopentanol C5H12O PHTQWCKDNZKARW-UHFFFAOYSA-N -HMDB0006029 188.079706882 N-Acetylglutamine C7H12N2O4 KSMRODHGGIIXDV-UHFFFAOYSA-N -HMDB0006050 181.073893223 o-Tyrosine C9H11NO3 WRFPVMFCRNYQNR-UHFFFAOYSA-N -HMDB0006088 180.063388116 scyllo-Inositol C6H12O6 CDAISMWEOUEBRE-CDRYSYESSA-N -HMDB0006101 298.120509064 Enterolactone C18H18O4 HVDGDHBAMCBBLR-UHFFFAOYSA-N -HMDB0006115 106.041864814 Benzaldehyde C7H6O HUMNYLRZRPPJDN-UHFFFAOYSA-N -HMDB0006116 195.053157781 "3-Hydroxyhippuric acid" C9H9NO4 XDOFWFNMYJRHEW-UHFFFAOYSA-N -HMDB0006119 402.349780716 7b-Hydroxycholesterol C27H46O2 OYXZMSRRJOYLLO-KGZHIOMZSA-N -HMDB0006225 428.329045274 Ercalcitriol C28H44O3 ZGLHBRQAEXKACO-XJRQOBMKSA-N -HMDB0006236 120.057514878 Phenylacetaldehyde C8H8O DTUQWGWMVIHBKE-UHFFFAOYSA-N -HMDB0006248 218.090271568 gamma-Glutamylalanine C8H14N2O5 WQXXXVRAFAKQJM-WHFBIAKZSA-N -HMDB0006270 280.240230268 "Linoelaidic acid" C18H32O2 OYHQOLUKZRVURQ-AVQMFFATSA-N -HMDB0006317 397.319208869 "trans-Hexadec-2-enoyl carnitine" C23H43NO4 SOYNLLDADLOGAM-ISLYRVAYSA-N -HMDB0006327 424.334130652 Alpha-Tocotrienol C29H44O2 RZFHLOLGZPDCHJ-XZXLULOTSA-N -HMDB0006335 416.36543078 Beta-tocopherol C28H48O2 WGVKWNUPNGFDFJ-DQCZWYHMSA-N -HMDB0006344 264.11100701 Phenylacetylglutamine C13H16N2O4 JFLIEFSWGNOPJJ-JTQLQIEISA-N -HMDB0006409 217.040878535 Tyramine-O-sulfate C8H11NO4S DYDUXGMDSXJQFT-UHFFFAOYSA-N -HMDB0006464 425.350508997 "Elaidic carnitine" C25H47NO4 IPOLTUVFXFHAHI-OUKQBFOZSA-N -HMDB0006469 423.334858933 "Linoleyl carnitine" C25H45NO4 MJLXQSQYKZWZCB-DQFWFXSYSA-N -HMDB0006478 86.073164942 Iso-Valeraldehyde C5H10O YGHRJJRRZDOVPD-UHFFFAOYSA-N -HMDB0006483 133.037507717 "D-Aspartic acid" C4H7NO4 CKLJMWTZIZZHCS-UWTATZPHSA-N -HMDB0006509 102.128274517 "Nervonyl carnitine" C6H16N GSBKRFGXEJLVMI-UHFFFAOYSA-N -HMDB0006525 136.125200515 (+)-a-Pinene C10H16 GRWFGVWFFZKLTI-UHFFFAOYSA-N -HMDB0006528 330.255880332 "Docosapentaenoic acid (22n-3)" C22H34O2 YUFFSWGQGVEMMI-JLNKQSITSA-N -HMDB0006547 276.20893014 "Stearidonic acid" C18H28O2 JIWBIWFOSCKQMA-LTKCOYKYSA-N -HMDB0006580 999.364225123 Lacto-N-difucohexaose C38H65NO29 PSJVAGXZRSPYJB-UUXGNFCPSA-N -HMDB0006589 998.343824032 "Sialyllacto-N-tetraose a" C37H62N2O29 QUOQJNYANJQSDA-MHQSSNGYSA-N -HMDB0006594 1289.439240557 Disialyllacto-N-tetraose C48H79N3O37 FCIROHDMPFOSFG-LAVSNGQLSA-N -HMDB0006600 998.343824032 "Sialyllacto-N-tetraose b" C37H62N2O29 SFMRPVLZMVJKGZ-JRZQLMJNSA-N -HMDB0006602 1072.380603468 Lacto-N-hexaose C40H68N2O31 ZDZMLVPSYYRJNI-VHFVHBOSSA-N -HMDB0006631 998.343824032 "Sialyllacto-N-tetraose c" C37H62N2O29 SXMGGNXBTZBGLU-UHFFFAOYSA-N -HMDB0006643 1218.438512276 Lacto-N-fucoheptaose C46H78N2O35 DUUXDOCGEHMZIH-UHFFFAOYSA-N -HMDB0006694 1364.496421084 Difucosyllacto-N-hexaose C52H88N2O39 SUSQQDGHFAOUBW-PVLJGHBYSA-N -HMDB0006707 794.621311112 "Coenzyme Q9" C54H82O4 UUGXJSBPSRROMU-WJNLUYJISA-N -HMDB0006737 704.647131932 CE(22:2(13Z,16Z)) C49H84O2 YSGVSTJGBYXXIM-OVUVNFMNSA-N -HMDB0006750 861.617741875 "Lactosylceramide (d18:1/16:0)" C46H87NO13 HLIJNIKSBCIDGO-QKLMXXKVSA-N -HMDB0006756 346.214409448 21-Hydroxy-5b-pregnane-3,11,20-trione C21H30O4 ZDUVZJUTJOBJHS-HNEBDTNWSA-N -HMDB0006809 256.082112185 "Nicotinate D-ribonucleoside" C11H14NO6 PUEDDPCUCPRQNY-ZYUZMQFOSA-O -HMDB0006899 146.069142196 Alanylglycine C5H10N2O3 CXISPYVYMQWFLE-UHFFFAOYSA-N -HMDB0006961 74.036779436 Hydroxyacetone C3H6O2 XLSMFKSTNGKWQX-UHFFFAOYSA-N -HMDB0007014 566.491025222 DG(14:0/18:1(11Z)/0:0) C35H66O5 XITYIRJXXQNQKT-ZWOXTJJBSA-N -HMDB0007015 566.491025222 DG(14:0/18:1(9Z)/0:0) C35H66O5 XEQQGHISHUGMIP-ASUORMEESA-N -HMDB0007016 564.475375158 DG(14:0/18:2(9Z,12Z)/0:0) C35H64O5 WVBVUWWRPSWGDS-JWVBYZEHSA-N -HMDB0007032 614.491025222 DG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) C39H66O5 ILUYFTWKNLJHOS-BJTCJBOMSA-N -HMDB0007033 614.491025222 DG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0) C39H66O5 UNAUUXGPAPFTQK-MTCOIHPXSA-N -HMDB0007034 612.475375158 DG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) C39H64O5 FRUADKDVYOLUEU-RWYVPCEMSA-N -HMDB0007060 614.491025222 DG(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)/0:0) C39H66O5 PVIFENQCGOXOHK-ADJKREHHSA-N -HMDB0007061 612.475375158 DG(14:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) C39H64O5 VJQIPMXNHWLHEJ-WCNLUZKGSA-N -HMDB0007062 612.475375158 DG(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/0:0) C39H64O5 QSZQNXRKRGRBGH-ABHQEDCTSA-N -HMDB0007079 608.537975414 DG(15:0/20:1(11Z)/0:0) C38H72O5 DICYCLUXEYFAQX-ORMHLZIJSA-N -HMDB0007099 566.491025222 DG(16:0/16:1(9Z)/0:0) C35H66O5 ADLOEVQMJKYKSR-YAIMUBSCSA-N -HMDB0007101 594.52232535 DG(16:0/18:1(11Z)/0:0) C37H70O5 IIEPDWHEGOSXLD-NMYQGLQJSA-N -HMDB0007102 594.52232535 DG(16:0/18:1(9Z)/0:0) C37H70O5 YEJYLHKQOBOSCP-OZKTZCCCSA-N -HMDB0007103 592.506675286 DG(16:0/18:2(9Z,12Z)/0:0) C37H68O5 SVXWJFFKLMLOHO-YAIZGCQRSA-N -HMDB0007114 614.491025222 DG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C39H66O5 WLYFADQAJKNNQG-DEWGQWFUSA-N -HMDB0007141 614.491025222 DG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/0:0) C39H66O5 IVRNQYIPGILFPZ-SEKRGLSRSA-N -HMDB0007142 614.491025222 DG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/0:0) C39H66O5 CMBHKSKRJUUOQH-YGFCVJAISA-N -HMDB0007143 612.475375158 DG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C39H64O5 MUYDIVLBRBWUDW-JCIONVESSA-N -HMDB0007175 676.60057567 DG(18:0/22:2(13Z,16Z)/0:0) C43H80O5 CPEWURNZWJEDDC-CMFLVMKTSA-N -HMDB0007177 670.553625478 DG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) C43H74O5 LTTZSZYLXABAOL-PYZFZJQXSA-N -HMDB0007178 670.553625478 DG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0) C43H74O5 JDCKQBKHWBEMSZ-QYYXEFEZSA-N -HMDB0007179 668.537975414 DG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) C43H72O5 LBDXVTOFXXDOGH-KXYFHQNYSA-N -HMDB0007187 622.553625478 DG(18:1(11Z)/18:0/0:0) C39H74O5 FENDTVWNLRYBGG-SFVGVZPYSA-N -HMDB0007188 620.537975414 DG(18:1(11Z)/18:1(11Z)/0:0) C39H72O5 JQTCHIYVEDEVBR-ZHDGQSQGSA-N -HMDB0007189 620.537975414 DG(18:1(11Z)/18:1(9Z)/0:0) C39H72O5 SRHKYLVXCXLCRK-NZSGFQRZSA-N -HMDB0007193 614.491025222 DG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/0:0) C39H66O5 RJZXOVDQLWQIPM-MUYODOAPSA-N -HMDB0007199 642.52232535 DG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/0:0) C41H70O5 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DG(18:2(9Z,12Z)/18:2(9Z,12Z)/0:0) C39H68O5 MQGBAQLIFKSMEM-ZHARMHCNSA-N -HMDB0007249 614.491025222 DG(18:2(9Z,12Z)/18:3(6Z,9Z,12Z)/0:0) C39H66O5 ZDBLXLQFRZTIIU-ZEYSAPHZSA-N -HMDB0007250 614.491025222 DG(18:2(9Z,12Z)/18:3(9Z,12Z,15Z)/0:0) C39H66O5 PGXBELQFNRPKBC-WBVIKXMWSA-N -HMDB0007251 612.475375158 DG(18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/0:0) C39H64O5 BYLXXZYUDXCZFN-YQRUEVQWSA-N -HMDB0007257 640.506675286 DG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/0:0) C41H68O5 KRECEGQUDDMNAQ-MYBRWWDOSA-N -HMDB0007258 640.506675286 DG(18:2(9Z,12Z)/20:4(8Z,11Z,14Z,17Z)/0:0) C41H68O5 XQKXAZZSUMABAU-HKOSRXLCSA-N -HMDB0007263 668.537975414 DG(18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/0:0) C43H72O5 REWOPMLGNOGDCI-IUTJGAPQSA-N -HMDB0007277 614.491025222 DG(18:3(6Z,9Z,12Z)/18:2(9Z,12Z)/0:0) C39H66O5 NEYUIEVYOYUWGW-AGNGCCSQSA-N -HMDB0007278 612.475375158 DG(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)/0:0) C39H64O5 JVRVKOOOXHGJKI-ITLZUPGPSA-N -HMDB0007279 612.475375158 DG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/0:0) C39H64O5 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DG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/0:0) C43H72O5 FUDGZBMOORLTCG-FCDTXGFCSA-N -HMDB0007375 670.553625478 DG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C43H74O5 QEOYMVJQPHELJB-YXHLBBQNSA-N -HMDB0007402 670.553625478 DG(20:1(11Z)/20:4(5Z,8Z,11Z,14Z)/0:0) C43H74O5 NSVJKGBXOPSAKL-XZUVHLGKSA-N -HMDB0007403 670.553625478 DG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/0:0) C43H74O5 ADQHTXPTSHXNKF-ZOXQJHRNSA-N -HMDB0007404 668.537975414 DG(20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C43H72O5 KXSTZGDSFQAWPR-KFALEISNSA-N -HMDB0007429 670.553625478 DG(20:2(11Z,14Z)/20:3(5Z,8Z,11Z)/0:0) C43H74O5 SPGHLBKMJHHORH-XASTUVSNSA-N -HMDB0007430 670.553625478 DG(20:2(11Z,14Z)/20:3(8Z,11Z,14Z)/0:0) C43H74O5 LQWVDOZRCDULIP-FFNILDJDSA-N -HMDB0007431 668.537975414 DG(20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/0:0) C43H72O5 XWQMGVSLXBIWRI-SXIWVUKCSA-N -HMDB0007432 668.537975414 DG(20:2(11Z,14Z)/20:4(8Z,11Z,14Z,17Z)/0:0) C43H72O5 PXRRYGSMQCZOCW-CRZFWNKOSA-N -HMDB0007457 670.553625478 DG(20:3(5Z,8Z,11Z)/20:2(11Z,14Z)/0:0) C43H74O5 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DG(20:4(8Z,11Z,14Z,17Z)/20:1(11Z)/0:0) C43H74O5 UCEIHNHHMYDTNZ-GHHPGRLNSA-N -HMDB0007544 668.537975414 DG(20:4(8Z,11Z,14Z,17Z)/20:2(11Z,14Z)/0:0) C43H72O5 CMOADEJDYGMJFA-WUIAEINNSA-N -HMDB0007562 614.491025222 DG(20:5(5Z,8Z,11Z,14Z,17Z)/16:0/0:0) C39H66O5 NXYFOPFKIDKTMC-MISHMQECSA-N -HMDB0007563 612.475375158 DG(20:5(5Z,8Z,11Z,14Z,17Z)/16:1(9Z)/0:0) C39H64O5 CQHRDRZMSJCJBX-JTQUUNRESA-N -HMDB0007571 670.553625478 DG(20:5(5Z,8Z,11Z,14Z,17Z)/20:0/0:0) C43H74O5 RIRRWYKZEDZUDS-XHJGARTISA-N -HMDB0007572 668.537975414 DG(20:5(5Z,8Z,11Z,14Z,17Z)/20:1(11Z)/0:0) C43H72O5 HPTHPDWEVHVEGM-GJSVQJKPSA-N -HMDB0007628 670.553625478 DG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/0:0) C43H74O5 BXPLJLDIGVRTRM-YARBERQDSA-N -HMDB0007655 670.553625478 DG(22:2(13Z,16Z)/18:3(6Z,9Z,12Z)/0:0) C43H74O5 RQWLSMTYYCMIJQ-GHKLHFTNSA-N -HMDB0007656 670.553625478 DG(22:2(13Z,16Z)/18:3(9Z,12Z,15Z)/0:0) C43H74O5 KVDLGXAZPYNPJG-KUSRJDHNSA-N -HMDB0007657 668.537975414 DG(22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)/0:0) C43H72O5 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DG(22:5(7Z,10Z,13Z,16Z,19Z)/14:0/0:0) C39H66O5 ZVROWTOTBSWALZ-MTCOIHPXSA-N -HMDB0007734 612.475375158 DG(22:5(7Z,10Z,13Z,16Z,19Z)/14:1(9Z)/0:0) C39H64O5 XJELJGCMEUSYKS-ABHQEDCTSA-N -HMDB0007738 670.553625478 DG(22:5(7Z,10Z,13Z,16Z,19Z)/18:0/0:0) C43H74O5 RMUBRZSHPSLPPN-KHQAGVLASA-N -HMDB0007739 668.537975414 DG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(11Z)/0:0) C43H72O5 OAUHLSFRFTZERV-OEMUPAMISA-N -HMDB0007740 668.537975414 DG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/0:0) C43H72O5 GECUAKBGRVJUJU-GRVHNFGUSA-N -HMDB0007762 612.475375158 DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:0/0:0) C39H64O5 LLOBOJAKMZHEKH-GVYMSAMVSA-N -HMDB0007767 668.537975414 DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:0/0:0) C43H72O5 FEIXBHFPDYRMBE-ATZSXMIDSA-N -HMDB0007788 712.506675286 DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) C47H68O5 XIAZEYRSKHAPND-CYDJSWNTSA-N -HMDB0007847 790.741426246 DG(24:1(15Z)/24:0/0:0) C51H98O5 YUFFMVIZZQIBPN-GBCBJHACSA-N -HMDB0007848 788.725776182 DG(24:1(15Z)/24:1(15Z)/0:0) C51H96O5 SOWAPPIVBQCDGN-BTOFNRAGSA-N -HMDB0007849 410.243340114 LysoPA(0:0/16:0) C19H39O7P LPQBQFLKBCPNAV-UHFFFAOYSA-N -HMDB0007850 438.274640242 LysoPA(0:0/18:0) C21H43O7P RPAOEHFOGLEBTJ-UHFFFAOYSA-N -HMDB0007853 410.243340114 LysoPA(16:0/0:0) C19H39O7P YNDYKPRNFWPPFU-UHFFFAOYSA-N -HMDB0007854 438.274640723 LysoPA(18:0/0:0) C21H43O7P LAYXSTYJRSVXIH-UHFFFAOYSA-N -HMDB0007856 434.243340594 LysoPA(18:2(9Z,12Z)/0:0) C21H39O7P ZQTAMPRZFOOEEP-HZJYTTRNSA-N -HMDB0007869 705.530854925 PC(14:0/16:0) C38H76NO8P RFVFQQWKPSOBED-PSXMRANNSA-N -HMDB0007872 731.546504989 PC(14:0/18:1(11Z)) C40H78NO8P GMJKBBMXRYZKEP-WYRBGLKBSA-N -HMDB0007873 731.546504989 PC(14:0/18:1(9Z)) C40H78NO8P NXASLICYTANYBI-OQHNRNOKSA-N -HMDB0007874 729.530854925 PC(14:0/18:2(9Z,12Z)) C40H76NO8P IWXJKHSPEQSQMD-GMGFYYQASA-N -HMDB0007875 727.515204861 PC(14:0/18:3(6Z,9Z,12Z)) C40H74NO8P VZQRMZUULSWEHB-XCFXQIAYSA-N -HMDB0007876 727.515204861 PC(14:0/18:3(9Z,12Z,15Z)) C40H74NO8P AGQKQQAJRFTOGL-XPTMXNASSA-N -HMDB0007877 725.499554797 PC(14:0/18:4(6Z,9Z,12Z,15Z)) C40H72NO8P SZQBOFQJPDNGHN-HTICVQCJSA-N -HMDB0007879 759.577805117 PC(14:0/20:1(11Z)) C42H82NO8P DMEBDXIQFIKNQR-OIJJMQLXSA-N -HMDB0007880 757.562155053 PC(14:0/20:2(11Z,14Z)) C42H80NO8P IRYMXEVDAKMFIF-YBLKGUNISA-N -HMDB0007881 755.546504989 PC(14:0/20:3(5Z,8Z,11Z)) C42H78NO8P XWHIBISICRMDDW-ZLBNXBDKSA-N -HMDB0007882 755.546504989 PC(14:0/20:3(8Z,11Z,14Z)) C42H78NO8P ZAUFLMLTXNKVAB-AFYHZPHLSA-N -HMDB0007883 753.530854925 PC(14:0/20:4(5Z,8Z,11Z,14Z)) C42H76NO8P SRQSAJRUMDQMMS-NLDJLLEISA-N -HMDB0007884 753.530854925 PC(14:0/20:4(8Z,11Z,14Z,17Z)) C42H76NO8P BXZPYXMUABUWBT-JAHIUHDMSA-N -HMDB0007886 789.624755309 PC(14:0/22:0) C44H88NO8P KNQNJCODLDRFSM-HUESYALOSA-N -HMDB0007887 787.609105245 PC(14:0/22:1(13Z)) C44H86NO8P LOVKBDFNFACEND-HSEDGGQWSA-N -HMDB0007888 785.593455181 PC(14:0/22:2(13Z,16Z)) C44H84NO8P BRAPXNOAYHMWEX-JHHJWKSXSA-N -HMDB0007889 781.562155053 PC(14:0/22:4(7Z,10Z,13Z,16Z)) C44H80NO8P UDOCLKXJVMJFLD-CCHOKCMJSA-N -HMDB0007890 779.546504989 PC(14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C44H78NO8P MGUTYWPZCZBAGE-JZDIRDTQSA-N -HMDB0007891 779.546504989 PC(14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C44H78NO8P SFEMWZZGMMRGCX-DYPKKMQZSA-N -HMDB0007892 777.530854925 PC(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C44H76NO8P HAIPHKFLSXSDAN-BLOCXYQCSA-N -HMDB0007893 817.656055437 PC(14:0/24:0) C46H92NO8P HZKNKWPYIHKKKL-USYZEHPZSA-N -HMDB0007894 815.640405373 PC(14:0/24:1(15Z)) C46H90NO8P GIPZQCAVEQRWOM-IKJFKDIMSA-N -HMDB0007895 689.535940303 PC(14:0/P-16:0) C38H76NO7P JCYQQPUPIWZLSG-MEIHLTSWSA-N -HMDB0007897 715.551590367 PC(14:0/P-18:1(11Z)) C40H78NO7P YRMZQKFOVROEJO-NKTXNVSESA-N -HMDB0007898 715.551590367 PC(14:0/P-18:1(9Z)) C40H78NO7P JWHYYJPWODHUBX-FWMFHLHFSA-N -HMDB0007899 675.483904733 PC(14:1(9Z)/14:0) C36H70NO8P XQPYHFHTTVXZKL-XBEBLRSGSA-N -HMDB0007903 701.499554797 PC(14:1(9Z)/16:1(9Z)) C38H72NO8P RUTXZOOOUKHIRR-KQGJYXFZSA-N -HMDB0007904 731.546504989 PC(14:1(9Z)/18:0) C40H78NO8P USMRUWLOXQOAAX-IUXSEFJDSA-N -HMDB0007905 729.530854925 PC(14:1(9Z)/18:1(11Z)) C40H76NO8P QNWUSMHOBHFMNS-MIXVWNHBSA-N -HMDB0007906 729.530854925 PC(14:1(9Z)/18:1(9Z)) C40H76NO8P KFGSHFVDCHWRGE-LULHKCDZSA-N -HMDB0007907 727.515204861 PC(14:1(9Z)/18:2(9Z,12Z)) C40H74NO8P FLXFESILEUFIBE-SHAXIEEXSA-N -HMDB0007908 725.499554797 PC(14:1(9Z)/18:3(6Z,9Z,12Z)) C40H72NO8P MVGBUJJTKGIFFM-OTEGYGNMSA-N -HMDB0007909 725.499554797 PC(14:1(9Z)/18:3(9Z,12Z,15Z)) C40H72NO8P BPBWECRGAITUAO-RPHNJZPISA-N -HMDB0007911 759.577805117 PC(14:1(9Z)/20:0) C42H82NO8P SJLGFZBXPQKJIH-LLVYEJTBSA-N -HMDB0007912 757.562155053 PC(14:1(9Z)/20:1(11Z)) C42H80NO8P OLUKQTJCNPHKRC-LYJZGNKWSA-N -HMDB0007913 755.546504989 PC(14:1(9Z)/20:2(11Z,14Z)) C42H78NO8P KBHCBANQRIOXLD-FRPVHTQQSA-N -HMDB0007914 753.530854925 PC(14:1(9Z)/20:3(5Z,8Z,11Z)) C42H76NO8P PONMSDSBSOWGHR-DKHJBHHKSA-N -HMDB0007915 753.530854925 PC(14:1(9Z)/20:3(8Z,11Z,14Z)) C42H76NO8P MGHZJKXUBUUNJR-PCBJBAEXSA-N -HMDB0007919 787.609105245 PC(14:1(9Z)/22:0) C44H86NO8P OSTGKIDWKPXCRQ-FASREOMLSA-N -HMDB0007920 785.593455181 PC(14:1(9Z)/22:1(13Z)) C44H84NO8P CGXBWJDAGMQUFG-MHJIJCEHSA-N -HMDB0007921 783.577805117 PC(14:1(9Z)/22:2(13Z,16Z)) C44H82NO8P LMYYUVAVNWPEPG-GXAHKNHCSA-N -HMDB0007922 779.546504989 PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C44H78NO8P XBLSNYPBWMKQLW-WPNBCRARSA-N -HMDB0007923 777.530854925 PC(14:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C44H76NO8P KFMGBOJDAOKOJL-OBYOARCJSA-N -HMDB0007924 777.530854925 PC(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C44H76NO8P QXPGEDBVJUZDLW-WKOATJLPSA-N -HMDB0007926 815.640405373 PC(14:1(9Z)/24:0) C46H90NO8P CGKBIHDFAQJNDL-KTKPPDABSA-N -HMDB0007929 715.551590367 PC(14:1(9Z)/P-18:0) C40H78NO7P KSNPZAABSICMCR-CQWYKKOZSA-N -HMDB0007930 713.535940303 PC(14:1(9Z)/P-18:1(11Z)) C40H76NO7P AWIMNAYXZNZGLW-NGYPZWAFSA-N -HMDB0007931 713.535940303 PC(14:1(9Z)/P-18:1(9Z)) C40H76NO7P LJBPTQCYACDIMR-WLTDODEOSA-N -HMDB0007934 705.530854925 PC(15:0/15:0) C38H76NO8P LJARBVLDSOWRJT-PSXMRANNSA-N -HMDB0007965 705.530854925 PC(16:0/14:0) C38H76NO8P UIXXHROAQSBBOV-PSXMRANNSA-N -HMDB0007969 731.546504989 PC(16:0/16:1(9Z)) C40H78NO8P QIBZFHLFHCIUOT-NPBIGWJUSA-N -HMDB0007971 759.577805117 PC(16:0/18:1(11Z)) C42H82NO8P AEPVLLKGEBHLEJ-KWNHIAGJSA-N -HMDB0007972 759.577805117 PC(16:0/18:1(9Z)) C42H82NO8P WTJKGGKOPKCXLL-VYOBOKEXSA-N -HMDB0007973 757.562155053 PC(16:0/18:2(9Z,12Z)) C42H80NO8P JLPULHDHAOZNQI-ZTIMHPMXSA-N -HMDB0007974 755.546504989 PC(16:0/18:3(6Z,9Z,12Z)) C42H78NO8P CNNSEHUKQJCGTE-UPPWDXJYSA-N -HMDB0007975 755.546504989 PC(16:0/18:3(9Z,12Z,15Z)) C42H78NO8P JMAYDGBZRHQJAT-QWFQJEORSA-N -HMDB0007976 753.530854925 PC(16:0/18:4(6Z,9Z,12Z,15Z)) C42H76NO8P USCDCOXUROEQQA-ZPWYYLPXSA-N -HMDB0007977 789.624755309 PC(16:0/20:0) C44H88NO8P HVPURDWMANOTFO-HUESYALOSA-N -HMDB0007978 787.609105245 PC(16:0/20:1(11Z)) C44H86NO8P MZZHKIPFYPOYKP-NYJULOOZSA-N -HMDB0007979 785.593455181 PC(16:0/20:2(11Z,14Z)) C44H84NO8P ZRTZULWIAWDUBY-UXSLIEDSSA-N -HMDB0007980 783.577805117 PC(16:0/20:3(5Z,8Z,11Z)) C44H82NO8P XMZFUVYOYPLVOA-VLHUWQDUSA-N -HMDB0007981 783.577805117 PC(16:0/20:3(8Z,11Z,14Z)) C44H82NO8P SRIGHEHXEGELQJ-YYQUKWHJSA-N -HMDB0007982 781.562155053 PC(16:0/20:4(5Z,8Z,11Z,14Z)) C44H80NO8P IIZPXYDJLKNOIY-JXPKJXOSSA-N -HMDB0007983 781.562155053 PC(16:0/20:4(8Z,11Z,14Z,17Z)) C44H80NO8P JAVWFBAAZSHHAD-HCYAGMRRSA-N -HMDB0007984 779.546504989 PC(16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C44H78NO8P KLTHQSWIRFFBRI-CPFPVJFHSA-N -HMDB0007985 817.656055437 PC(16:0/22:0) C46H92NO8P GHBAFISLPNCOEP-USYZEHPZSA-N -HMDB0007986 815.640405373 PC(16:0/22:1(13Z)) C46H90NO8P BBIXKOPOMMUIOM-UIJSWADASA-N -HMDB0007988 809.593455181 PC(16:0/22:4(7Z,10Z,13Z,16Z)) C46H84NO8P IRWRFKUTKSUFST-MDYGELLQSA-N -HMDB0007989 807.577805117 PC(16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C46H82NO8P MWXAIAMSOXOQJK-JIXVGTEKSA-N -HMDB0007990 807.577805117 PC(16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C46H82NO8P ARDJUHDXABDVFH-ZHSIBHBUSA-N -HMDB0007991 805.562155053 PC(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H80NO8P IESVDEZGAHUQJU-ZLBXKVHBSA-N -HMDB0007992 845.687355565 PC(16:0/24:0) C48H96NO8P UEWKKZXJWBVMLY-YACUFSJGSA-N -HMDB0007993 843.671705501 PC(16:0/24:1(15Z)) C48H94NO8P XUCOLWONUSFHRC-QFQSVWFISA-N -HMDB0007996 743.582890495 PC(16:0/P-18:1(11Z)) C42H82NO7P MPQGNHKVOVYEEN-RTVLTNFHSA-N -HMDB0007997 743.582890495 PC(16:0/P-18:1(9Z)) C42H82NO7P UQCSRPHVLJIYTA-ADJITVTDSA-N -HMDB0007999 701.499554797 PC(16:1(9Z)/14:1(9Z)) C38H72NO8P WEVWHXAKLAWWAP-KQGJYXFZSA-N -HMDB0008001 731.546504989 PC(16:1(9Z)/16:0) C40H78NO8P IPMVHVDAYPUFKH-WYRBGLKBSA-N -HMDB0008002 729.530854925 PC(16:1(9Z)/16:1(9Z)) C40H76NO8P GPWHCUUIQMGELX-VHQDNGOZSA-N -HMDB0008003 759.577805117 PC(16:1(9Z)/18:0) C42H82NO8P LJUDFFWSOQEQKW-QCFYSATCSA-N -HMDB0008004 757.562155053 PC(16:1(9Z)/18:1(11Z)) C42H80NO8P JUVGBPLHSDPAMK-JSLHZOBYSA-N -HMDB0008005 757.562155053 PC(16:1(9Z)/18:1(9Z)) C42H80NO8P ZRCWDIULNHKQRD-RWGOWQMXSA-N -HMDB0008006 755.546504989 PC(16:1(9Z)/18:2(9Z,12Z)) C42H78NO8P QJWDAOSZZYVBJZ-KXESGEQTSA-N -HMDB0008007 753.530854925 PC(16:1(9Z)/18:3(6Z,9Z,12Z)) C42H76NO8P ZZLFVAJFRYBVSN-URBNVOGLSA-N -HMDB0008008 753.530854925 PC(16:1(9Z)/18:3(9Z,12Z,15Z)) C42H76NO8P MMUCLZZSNHBNFL-KBTBXKTRSA-N -HMDB0008010 787.609105245 PC(16:1(9Z)/20:0) C44H86NO8P YFGYYMPGHQJKLU-HTDYWKJCSA-N -HMDB0008011 785.593455181 PC(16:1(9Z)/20:1(11Z)) C44H84NO8P RPEHVLWFOYUNMD-NPCYKUJHSA-N -HMDB0008012 783.577805117 PC(16:1(9Z)/20:2(11Z,14Z)) C44H82NO8P IIGHFIDXVYEMME-ZAEMQJNLSA-N -HMDB0008013 781.562155053 PC(16:1(9Z)/20:3(5Z,8Z,11Z)) C44H80NO8P SKHRULFMZYNDLW-IRKGUOCTSA-N -HMDB0008014 781.562155053 PC(16:1(9Z)/20:3(8Z,11Z,14Z)) C44H80NO8P SCFKGVINVZBYAF-MLQXCARSSA-N -HMDB0008015 779.546504989 PC(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C44H78NO8P DYDDZDMJSQYFGN-OIVUZXIWSA-N -HMDB0008016 779.546504989 PC(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C44H78NO8P NJKOHDXHBBUJBZ-HVRDEFPWSA-N -HMDB0008017 777.530854925 PC(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C44H76NO8P IITWSVMUNFGFQI-MMWBFVNXSA-N -HMDB0008018 815.640405373 PC(16:1(9Z)/22:0) C46H90NO8P PIILEMYAXFKXLL-VPMPJQFESA-N -HMDB0008020 811.609105245 PC(16:1(9Z)/22:2(13Z,16Z)) C46H86NO8P IHEXWEKEFCKFEL-UTIGHQPQSA-N -HMDB0008021 807.577805117 PC(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C46H82NO8P XJISBSFDFOVVHI-QIOBQPIHSA-N -HMDB0008022 805.562155053 PC(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C46H80NO8P WCODZEYPAWOVBI-UMQSOSPQSA-N -HMDB0008024 805.562155053 PC(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C46H80NO8P WNHOGFDQJFYPDE-GBGUCBAQSA-N -HMDB0008025 843.671705501 PC(16:1(9Z)/24:0) C48H94NO8P IFFKOYCNNLGBBE-VGURBHAXSA-N -HMDB0008026 841.656055437 PC(16:1(9Z)/24:1(15Z)) C48H92NO8P FVYIRCQXEGIKHY-QYQAGSNQSA-N -HMDB0008027 715.551590367 PC(16:1(9Z)/P-16:0) C40H78NO7P KQAIGMPEJCAVJO-JVTCOHPVSA-N -HMDB0008028 743.582890495 PC(16:1(9Z)/P-18:0) C42H82NO7P IHJLXDUOYHJZQE-IOGJYWBCSA-N -HMDB0008029 741.567240431 PC(16:1(9Z)/P-18:1(11Z)) C42H80NO7P ZFACUKICYTXONE-IWDZABBFSA-N -HMDB0008030 741.567240431 PC(16:1(9Z)/P-18:1(9Z)) C42H80NO7P UMCQOQMEDBTSBS-YJTQHARMSA-N -HMDB0008032 731.546504989 PC(18:0/14:1(9Z)) C40H78NO8P DHRQNMSQBJKUCK-IUXSEFJDSA-N -HMDB0008035 759.577805117 PC(18:0/16:1(9Z)) C42H82NO8P QRSPNOMDLRZDPG-QCFYSATCSA-N -HMDB0008036 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VRXRAEQYIWJLSH-OCTHSLKYSA-N -HMDB0008366 811.609105245 PC(20:3(5Z,8Z,11Z)/18:0) C46H86NO8P ZQCXMBYHCICNPX-FIAOWNBRSA-N -HMDB0008367 809.593455181 PC(20:3(5Z,8Z,11Z)/18:1(11Z)) C46H84NO8P PIOANQACZQFPEA-UKBQUFHJSA-N -HMDB0008368 809.593455181 PC(20:3(5Z,8Z,11Z)/18:1(9Z)) C46H84NO8P PUTMVZMHYSWRJX-PAQAJSBVSA-N -HMDB0008369 807.577805117 PC(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C46H82NO8P SKQBFCOATFWTGJ-GGVIMJHGSA-N -HMDB0008370 805.562155053 PC(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)) C46H80NO8P JEFBNJKATIUJOC-JZSVRCITSA-N -HMDB0008371 805.562155053 PC(20:3(5Z,8Z,11Z)/18:3(9Z,12Z,15Z)) C46H80NO8P SHGIXNQCFPEBAW-XVVPJXMMSA-N -HMDB0008373 839.640405373 PC(20:3(5Z,8Z,11Z)/20:0) C48H90NO8P ZZJQEMSWMGGWDG-OCRPJUMPSA-N -HMDB0008374 837.624755309 PC(20:3(5Z,8Z,11Z)/20:1(11Z)) C48H88NO8P LUPUCKHJOGTAAZ-VXKXFZBGSA-N -HMDB0008375 835.609105245 PC(20:3(5Z,8Z,11Z)/20:2(11Z,14Z)) C48H86NO8P AJNZABHWCGUHSJ-MSCOLSPSSA-N -HMDB0008376 833.593455181 PC(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)) C48H84NO8P ZITMTGXPTAXDMQ-LGFSYLBFSA-N -HMDB0008377 833.593455181 PC(20:3(5Z,8Z,11Z)/20:3(8Z,11Z,14Z)) C48H84NO8P JHMWTEQGLBMSLG-DMHZMEFUSA-N -HMDB0008382 865.656055437 PC(20:3(5Z,8Z,11Z)/22:1(13Z)) C50H92NO8P QLUBHBLHAFOGNI-FLBVHRRTSA-N -HMDB0008383 863.640405373 PC(20:3(5Z,8Z,11Z)/22:2(13Z,16Z)) C50H90NO8P VXVKOHXCHIOVRJ-VDUUJWIISA-N -HMDB0008390 767.582890495 PC(20:3(5Z,8Z,11Z)/P-16:0) C44H82NO7P CMAADAYMDIZIOR-YDGSBDHOSA-N -HMDB0008391 795.614190623 PC(20:3(5Z,8Z,11Z)/P-18:0) C46H86NO7P PLWKPRNKSDXLNG-KZWPABEFSA-N -HMDB0008392 793.598540559 PC(20:3(5Z,8Z,11Z)/P-18:1(11Z)) C46H84NO7P LRXLTVLBEDXONI-DSLLYOFSSA-N -HMDB0008393 793.598540559 PC(20:3(5Z,8Z,11Z)/P-18:1(9Z)) C46H84NO7P LOIZABDCVPDYRX-KPLHBETISA-N -HMDB0008394 755.546504989 PC(20:3(8Z,11Z,14Z)/14:0) C42H78NO8P VKVSSDKCKXJFIM-AFYHZPHLSA-N -HMDB0008395 753.530854925 PC(20:3(8Z,11Z,14Z)/14:1(9Z)) C42H76NO8P UGOXZVQDVQJYIN-PCBJBAEXSA-N -HMDB0008397 783.577805117 PC(20:3(8Z,11Z,14Z)/16:0) C44H82NO8P YKSVDDIMSQYNID-YYQUKWHJSA-N -HMDB0008398 781.562155053 PC(20:3(8Z,11Z,14Z)/16:1(9Z)) C44H80NO8P SMNBWWUNQGASFC-MLQXCARSSA-N -HMDB0008399 811.609105245 PC(20:3(8Z,11Z,14Z)/18:0) C46H86NO8P UTVPIFAQLMVRBR-DXLHFBPTSA-N -HMDB0008400 809.593455181 PC(20:3(8Z,11Z,14Z)/18:1(11Z)) C46H84NO8P QFSNCHKAROIETO-SSTUGHORSA-N -HMDB0008401 809.593455181 PC(20:3(8Z,11Z,14Z)/18:1(9Z)) C46H84NO8P SLKDYSINLYWLQQ-IGMUWBMCSA-N -HMDB0008402 807.577805117 PC(20:3(8Z,11Z,14Z)/18:2(9Z,12Z)) C46H82NO8P SUACBSWYGWBPFC-GPUJSUHJSA-N -HMDB0008403 805.562155053 PC(20:3(8Z,11Z,14Z)/18:3(6Z,9Z,12Z)) C46H80NO8P RIDIYDAFPMEWTP-AFNUAFPGSA-N -HMDB0008404 805.562155053 PC(20:3(8Z,11Z,14Z)/18:3(9Z,12Z,15Z)) C46H80NO8P ONHNZXQSGXKTJD-FKOQMNRQSA-N -HMDB0008406 839.640405373 PC(20:3(8Z,11Z,14Z)/20:0) C48H90NO8P NMVCKDUPYAOXCG-XGEOKNOUSA-N -HMDB0008407 835.609105245 PC(20:3(8Z,11Z,14Z)/20:2(11Z,14Z)) C48H86NO8P ORJYHUZZUPRLIN-UJBKIRDYSA-N -HMDB0008408 833.593455181 PC(20:3(8Z,11Z,14Z)/20:3(5Z,8Z,11Z)) C48H84NO8P STJMRHKIQNWSPV-HGWYWTLDSA-N -HMDB0008409 833.593455181 PC(20:3(8Z,11Z,14Z)/20:3(8Z,11Z,14Z)) C48H84NO8P UCQTXWKYRXXLSS-BLDRONNASA-N -HMDB0008414 865.656055437 PC(20:3(8Z,11Z,14Z)/22:1(13Z)) C50H92NO8P HILDKBKUEBHUIK-LEGLZOIHSA-N -HMDB0008415 863.640405373 PC(20:3(8Z,11Z,14Z)/22:2(13Z,16Z)) C50H90NO8P UPPLKKOOULIOMN-KTBPUXGBSA-N -HMDB0008422 767.582890495 PC(20:3(8Z,11Z,14Z)/P-16:0) C44H82NO7P YNEOKOLTTKSNFT-NXTBAPBJSA-N -HMDB0008423 795.614190623 PC(20:3(8Z,11Z,14Z)/P-18:0) C46H86NO7P IMISCMOUPRVKCY-JCOVWSEZSA-N -HMDB0008424 793.598540559 PC(20:3(8Z,11Z,14Z)/P-18:1(11Z)) C46H84NO7P CCNAQOMJOZUUNX-HPXLHRQISA-N -HMDB0008425 793.598540559 PC(20:3(8Z,11Z,14Z)/P-18:1(9Z)) C46H84NO7P LBPLYVPCWJRTGP-YLKVZILBSA-N -HMDB0008426 753.530854925 PC(20:4(5Z,8Z,11Z,14Z)/14:0) C42H76NO8P KMZWZYBLPBQHMP-PVHGPNMRSA-N -HMDB0008429 781.562155053 PC(20:4(5Z,8Z,11Z,14Z)/16:0) C44H80NO8P PUDHBQQGURLBGJ-IVFHWKNFSA-N -HMDB0008430 779.546504989 PC(20:4(5Z,8Z,11Z,14Z)/16:1(9Z)) C44H78NO8P KKRYRHYMXROGPM-SOVKMKKSSA-N -HMDB0008431 809.593455181 PC(20:4(5Z,8Z,11Z,14Z)/18:0) C46H84NO8P DNYKSJQVBCVGOF-LCKGXUDJSA-N -HMDB0008432 807.577805117 PC(20:4(5Z,8Z,11Z,14Z)/18:1(11Z)) C46H82NO8P YLWBKBDNHWQEFU-YJXJLLHLSA-N -HMDB0008433 807.577805117 PC(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) C46H82NO8P PJAVLQZDHFXHPI-IHBLHBMHSA-N -HMDB0008434 805.562155053 PC(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)) C46H80NO8P PLZBTDKJYHXIEW-DZUXOTHRSA-N -HMDB0008438 837.624755309 PC(20:4(5Z,8Z,11Z,14Z)/20:0) C48H88NO8P DXCCGBCVYMELBT-NDJZOZGISA-N -HMDB0008439 835.609105245 PC(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)) C48H86NO8P FFPFWVHSVNGQKW-RZYMAAGLSA-N -HMDB0008440 833.593455181 PC(20:4(5Z,8Z,11Z,14Z)/20:2(11Z,14Z)) C48H84NO8P RSXNDJUFSFNIRE-NYCYDASOSA-N -HMDB0008446 865.656055437 PC(20:4(5Z,8Z,11Z,14Z)/22:0) C50H92NO8P CVECNRQDBOYLEX-YUDFJFIPSA-N -HMDB0008447 863.640405373 PC(20:4(5Z,8Z,11Z,14Z)/22:1(13Z)) C50H90NO8P OEVPFOYLDULCHG-YEJSVZEHSA-N -HMDB0008448 861.624755309 PC(20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)) C50H88NO8P BVNCECIWLNSIHB-NYVXWPRKSA-N -HMDB0008455 765.567240431 PC(20:4(5Z,8Z,11Z,14Z)/P-16:0) C44H80NO7P QXWMNDJZPMHJJC-ZBYLXILXSA-N -HMDB0008456 793.598540559 PC(20:4(5Z,8Z,11Z,14Z)/P-18:0) C46H84NO7P HMEHDJIXXQDEJH-NRSCKOKFSA-N -HMDB0008457 791.582890495 PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z)) C46H82NO7P BKCKPUXEOILIKW-YNZCAZTGSA-N -HMDB0008458 791.582890495 PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(9Z)) C46H82NO7P XFZLVOWQACHWOM-KJYCNVMKSA-N -HMDB0008459 753.530854925 PC(20:4(8Z,11Z,14Z,17Z)/14:0) C42H76NO8P ZSYMQFVRTIVMFA-JAHIUHDMSA-N -HMDB0008462 781.562155053 PC(20:4(8Z,11Z,14Z,17Z)/16:0) C44H80NO8P JWAPTBDWCHGPTG-HCYAGMRRSA-N -HMDB0008463 779.546504989 PC(20:4(8Z,11Z,14Z,17Z)/16:1(9Z)) C44H78NO8P YZVMADINWPHQBY-HVRDEFPWSA-N -HMDB0008464 809.593455181 PC(20:4(8Z,11Z,14Z,17Z)/18:0) C46H84NO8P FBCNXALHPSQUQY-WKABSKOFSA-N -HMDB0008465 807.577805117 PC(20:4(8Z,11Z,14Z,17Z)/18:1(11Z)) C46H82NO8P AKLWUKOTFBFPBC-RCKQDAJWSA-N -HMDB0008466 807.577805117 PC(20:4(8Z,11Z,14Z,17Z)/18:1(9Z)) C46H82NO8P ZLBHNVZLAFHAEP-IVILLCNESA-N -HMDB0008467 805.562155053 PC(20:4(8Z,11Z,14Z,17Z)/18:2(9Z,12Z)) C46H80NO8P CEJUIQBITPKHHY-OWEZASBCSA-N -HMDB0008471 837.624755309 PC(20:4(8Z,11Z,14Z,17Z)/20:0) C48H88NO8P RWXBUUZTIJHTSZ-JYQFPUJJSA-N -HMDB0008472 835.609105245 PC(20:4(8Z,11Z,14Z,17Z)/20:1(11Z)) C48H86NO8P IJTJDJOOHZVSAC-NDRUHXFFSA-N -HMDB0008473 833.593455181 PC(20:4(8Z,11Z,14Z,17Z)/20:2(11Z,14Z)) C48H84NO8P ZKUNPSXZRWGSCW-FLRYMGIISA-N -HMDB0008479 865.656055437 PC(20:4(8Z,11Z,14Z,17Z)/22:0) C50H92NO8P XJLHAZSETMTODV-OTCDWEGQSA-N -HMDB0008480 863.640405373 PC(20:4(8Z,11Z,14Z,17Z)/22:1(13Z)) C50H90NO8P PTYNPEDSBXJXNP-LDJXKJQGSA-N -HMDB0008481 861.624755309 PC(20:4(8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) C50H88NO8P SNSJLBQXDCXZOQ-HKUTVFNDSA-N -HMDB0008488 765.567240431 PC(20:4(8Z,11Z,14Z,17Z)/P-16:0) C44H80NO7P YNVRQZFWYTWRSS-IXSFRKHYSA-N -HMDB0008489 793.598540559 PC(20:4(8Z,11Z,14Z,17Z)/P-18:0) C46H84NO7P LHWOPLZFGPHCMJ-AMFPDOHCSA-N -HMDB0008490 791.582890495 PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(11Z)) C46H82NO7P CRMVSSHWYQUQEP-IDSBLRLXSA-N -HMDB0008491 791.582890495 PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(9Z)) C46H82NO7P ATTCDOPAYPGSLE-LQULQHAGSA-N -HMDB0008495 779.546504989 PC(20:5(5Z,8Z,11Z,14Z,17Z)/16:0) C44H78NO8P SUZYROYNFNQALJ-MHEIZRSESA-N -HMDB0008496 777.530854925 PC(20:5(5Z,8Z,11Z,14Z,17Z)/16:1(9Z)) C44H76NO8P SHMZMMGXODYRCN-MHDABRLVSA-N -HMDB0008497 807.577805117 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:0) C46H82NO8P JKDOKILDEIEPFZ-LGPFJNBISA-N -HMDB0008498 805.562155053 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z)) C46H80NO8P KAAXHFGQTWYDKM-PDYZRCSUSA-N -HMDB0008499 805.562155053 PC(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)) C46H80NO8P JZKMYCPNBSRARO-YMBRLFDISA-N -HMDB0008504 835.609105245 PC(20:5(5Z,8Z,11Z,14Z,17Z)/20:0) C48H86NO8P SFESOYFQZQJCOY-FXYWPAEZSA-N -HMDB0008505 833.593455181 PC(20:5(5Z,8Z,11Z,14Z,17Z)/20:1(11Z)) C48H84NO8P OHMVGNUFBRUROI-JNOZGJMASA-N -HMDB0008512 863.640405373 PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:0) C50H90NO8P ZOAQJTIRBLFGSD-WWBXXLDESA-N -HMDB0008513 861.624755309 PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:1(13Z)) C50H88NO8P WAHVJMOUGUEABY-WEBHOWTESA-N -HMDB0008521 763.551590367 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-16:0) C44H78NO7P RPGDUWQZQBHLNS-XRTCNQNWSA-N -HMDB0008522 791.582890495 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:0) C46H82NO7P IWGDDCKYIXMJOA-RJFYQFCBSA-N -HMDB0008523 789.567240431 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z)) C46H80NO7P WDNOQSUMHJTAOV-RAUWIWGKSA-N -HMDB0008524 789.567240431 PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(9Z)) C46H80NO7P USPBFZFHJPVLST-HALYXBRLSA-N -HMDB0008525 789.624755309 PC(22:0/14:0) C44H88NO8P JFNNIQMJYCUZKY-HUESYALOSA-N -HMDB0008526 787.609105245 PC(22:0/14:1(9Z)) C44H86NO8P RGHFEAMZDBFLPO-FASREOMLSA-N -HMDB0008528 817.656055437 PC(22:0/16:0) C46H92NO8P OPUHJIZEYAXETG-USYZEHPZSA-N -HMDB0008529 815.640405373 PC(22:0/16:1(9Z)) C46H90NO8P FOYSSFIXMSIYBS-VPMPJQFESA-N -HMDB0008530 845.687355565 PC(22:0/18:0) C48H96NO8P XOEFPTAEGQLDQS-YACUFSJGSA-N -HMDB0008531 843.671705501 PC(22:0/18:1(11Z)) C48H94NO8P ZXUGYTRXWUMLQE-VGURBHAXSA-N -HMDB0008532 843.671705501 PC(22:0/18:1(9Z)) C48H94NO8P AWZDTGDSDIBXAE-MLLRONJJSA-N -HMDB0008533 841.656055437 PC(22:0/18:2(9Z,12Z)) C48H92NO8P LDQMGTRKTWSKIW-QGXZLJJESA-N -HMDB0008534 839.640405373 PC(22:0/18:3(6Z,9Z,12Z)) C48H90NO8P OFWRYSQDJOQSHU-FARFQYTLSA-N -HMDB0008535 839.640405373 PC(22:0/18:3(9Z,12Z,15Z)) C48H90NO8P JYFWSVLYQSTYHE-NOAWTOFZSA-N -HMDB0008536 837.624755309 PC(22:0/18:4(6Z,9Z,12Z,15Z)) C48H88NO8P LFDYHYAWJHIDTQ-GFEYAWDCSA-N -HMDB0008537 873.718655693 PC(22:0/20:0) C50H100NO8P BBKWJNNMTSKJKD-QSCHNALKSA-N -HMDB0008538 871.703005629 PC(22:0/20:1(11Z)) C50H98NO8P JTSFTWZTLBUFSL-ZPFYZEQDSA-N -HMDB0008539 869.687355565 PC(22:0/20:2(11Z,14Z)) C50H96NO8P LFYYYSNBZJRBSA-HHITYQTISA-N -HMDB0008542 865.656055437 PC(22:0/20:4(5Z,8Z,11Z,14Z)) C50H92NO8P YMTVBHIALYUAKW-HTJMAYPASA-N -HMDB0008543 865.656055437 PC(22:0/20:4(8Z,11Z,14Z,17Z)) C50H92NO8P BUDCKLMBPWXPIS-BVGFWLPASA-N -HMDB0008544 863.640405373 PC(22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C50H90NO8P OOXNKNWJYSZSBM-WECTVZTJSA-N -HMDB0008554 801.661140815 PC(22:0/P-16:0) C46H92NO7P VYMPOARESDCNFV-GJARRJKISA-N -HMDB0008555 829.692440943 PC(22:0/P-18:0) C48H96NO7P SDWOXAMRJOFVSY-SATDTQGDSA-N -HMDB0008556 827.676790879 PC(22:0/P-18:1(11Z)) C48H94NO7P JXHHUHJBJTZMAU-WMUWNWGGSA-N -HMDB0008557 827.676790879 PC(22:0/P-18:1(9Z)) C48H94NO7P BVFRKPUIHULJTC-YMTIIJDJSA-N -HMDB0008558 787.609105245 PC(22:1(13Z)/14:0) C44H86NO8P RSKUBXWDAIDNLE-HSEDGGQWSA-N -HMDB0008559 785.593455181 PC(22:1(13Z)/14:1(9Z)) C44H84NO8P CYQUGAJGPGKDFF-MHJIJCEHSA-N -HMDB0008561 815.640405373 PC(22:1(13Z)/16:0) C46H90NO8P QZSYHJOHCCQKPM-UIJSWADASA-N -HMDB0008563 843.671705501 PC(22:1(13Z)/18:0) C48H94NO8P UGQKWIBZUBBBNO-USIWBXHFSA-N -HMDB0008564 841.656055437 PC(22:1(13Z)/18:1(9Z)) C48H92NO8P CZZWUVSNBSTVTM-ACZCORRTSA-N -HMDB0008565 839.640405373 PC(22:1(13Z)/18:2(9Z,12Z)) C48H90NO8P QITWVLBMWWSFPO-PUXNAPJVSA-N -HMDB0008566 837.624755309 PC(22:1(13Z)/18:3(6Z,9Z,12Z)) C48H88NO8P BUYWHDOUDGEIHW-YEHISXKXSA-N -HMDB0008567 837.624755309 PC(22:1(13Z)/18:3(9Z,12Z,15Z)) C48H88NO8P FHUAYOMRHXZKHT-JUGJLYODSA-N -HMDB0008568 835.609105245 PC(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C48H86NO8P UCKDHIBTSOLZAW-OMGITNNSSA-N -HMDB0008569 871.703005629 PC(22:1(13Z)/20:0) C50H98NO8P GHUGFCZMTRWVKH-RURDTVAGSA-N -HMDB0008570 869.687355565 PC(22:1(13Z)/20:1(11Z)) C50H96NO8P RDVFINNZTUFVCO-PIUCSNMVSA-N -HMDB0008572 865.656055437 PC(22:1(13Z)/20:3(5Z,8Z,11Z)) C50H92NO8P UMAICRBPHIYESB-DNBQMDTNSA-N -HMDB0008573 865.656055437 PC(22:1(13Z)/20:3(8Z,11Z,14Z)) C50H92NO8P JPJFWRWQZROHJW-RSPSYKHISA-N -HMDB0008574 863.640405373 PC(22:1(13Z)/20:4(5Z,8Z,11Z,14Z)) C50H90NO8P JKAQBKZSISHZFU-MKCUTOGDSA-N -HMDB0008575 863.640405373 PC(22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C50H90NO8P WEJRANQJEZOPOW-GVCPMQPRSA-N -HMDB0008576 861.624755309 PC(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C50H88NO8P TXALYSQBNAXWFT-FFKTVFGFSA-N -HMDB0008586 799.645490751 PC(22:1(13Z)/P-16:0) C46H90NO7P FYJYHPBDOBPEFG-NYALRLSRSA-N -HMDB0008587 827.676790879 PC(22:1(13Z)/P-18:0) C48H94NO7P WQHDLBOZNGAUKM-QIWTVRBJSA-N -HMDB0008588 825.661140815 PC(22:1(13Z)/P-18:1(11Z)) C48H92NO7P VJMHNWXIJKHKHT-GYTYNKKYSA-N -HMDB0008589 825.661140815 PC(22:1(13Z)/P-18:1(9Z)) C48H92NO7P JLVZEZTUUWTBQT-FZHXXZEZSA-N -HMDB0008590 785.593455181 PC(22:2(13Z,16Z)/14:0) C44H84NO8P POKOLAWNECNRHW-JHHJWKSXSA-N -HMDB0008591 783.577805117 PC(22:2(13Z,16Z)/14:1(9Z)) C44H82NO8P AHJIOIOFNHUXKJ-GXAHKNHCSA-N -HMDB0008594 811.609105245 PC(22:2(13Z,16Z)/16:1(9Z)) C46H86NO8P GEAKOUDHDIZJPQ-UTIGHQPQSA-N -HMDB0008595 841.656055437 PC(22:2(13Z,16Z)/18:0) C48H92NO8P LAXKISCJOCARCS-SZAAGBBJSA-N -HMDB0008596 839.640405373 PC(22:2(13Z,16Z)/18:1(11Z)) C48H90NO8P JEEDOLIAMMVOTO-IMLSBYECSA-N -HMDB0008597 839.640405373 PC(22:2(13Z,16Z)/18:1(9Z)) C48H90NO8P GQOYHJFWEIXIGI-LJUWQHBFSA-N -HMDB0008598 837.624755309 PC(22:2(13Z,16Z)/18:2(9Z,12Z)) C48H88NO8P QQIYXJBHMDYXHH-NMUBDWGHSA-N -HMDB0008599 835.609105245 PC(22:2(13Z,16Z)/18:3(6Z,9Z,12Z)) C48H86NO8P GBWKGOXLSQQBGD-SRIFCXCDSA-N -HMDB0008600 835.609105245 PC(22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C48H86NO8P MNLODOXUTCKZPS-KCLVDFFQSA-N -HMDB0008601 833.593455181 PC(22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C48H84NO8P KZSXWBSDQDXESU-PPEVQBTRSA-N -HMDB0008602 869.687355565 PC(22:2(13Z,16Z)/20:0) C50H96NO8P UGLJQXWXHNGVFA-NWFGWYPUSA-N -HMDB0008604 865.656055437 PC(22:2(13Z,16Z)/20:2(11Z,14Z)) C50H92NO8P AGTWPYRVVNKJKX-OARALLPOSA-N -HMDB0008605 863.640405373 PC(22:2(13Z,16Z)/20:3(5Z,8Z,11Z)) C50H90NO8P SNCHHPIAZMAWKH-HLFKTMQUSA-N -HMDB0008606 863.640405373 PC(22:2(13Z,16Z)/20:3(8Z,11Z,14Z)) C50H90NO8P APYSSUSAYQRESE-VZWUYPTESA-N -HMDB0008607 861.624755309 PC(22:2(13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C50H88NO8P QLSMAUYBTKZUQV-DDABTYNPSA-N -HMDB0008608 861.624755309 PC(22:2(13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C50H88NO8P MADJLPBRDFZQHG-JNOHOMDFSA-N -HMDB0008620 825.661140815 PC(22:2(13Z,16Z)/P-18:0) C48H92NO7P WTPAHBSLQUJOMF-DJBJHQTKSA-N -HMDB0008621 823.645490751 PC(22:2(13Z,16Z)/P-18:1(11Z)) C48H90NO7P MWEZXEFKBKZJCZ-ARPDTERPSA-N -HMDB0008622 823.645490751 PC(22:2(13Z,16Z)/P-18:1(9Z)) C48H90NO7P ZDVKWGVDIXWINA-CLDXNVIQSA-N -HMDB0008623 781.562155053 PC(22:4(7Z,10Z,13Z,16Z)/14:0) C44H80NO8P FHBLNLYBVANDFG-CCHOKCMJSA-N -HMDB0008624 779.546504989 PC(22:4(7Z,10Z,13Z,16Z)/14:1(9Z)) C44H78NO8P UJZMLLMWTJZZJX-WPNBCRARSA-N -HMDB0008626 809.593455181 PC(22:4(7Z,10Z,13Z,16Z)/16:0) C46H84NO8P LKZIWAABXRQNGG-JAYRDFRFSA-N -HMDB0008627 807.577805117 PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) C46H82NO8P STHWQCYHQJBDDB-SYONOARRSA-N -HMDB0008628 837.624755309 PC(22:4(7Z,10Z,13Z,16Z)/18:0) C48H88NO8P YVFBVKJWPMCQQG-NRICRUJBSA-N -HMDB0008629 835.609105245 PC(22:4(7Z,10Z,13Z,16Z)/18:1(11Z)) C48H86NO8P JJGXBUHPKPRTOF-DPOPDSRASA-N -HMDB0008630 835.609105245 PC(22:4(7Z,10Z,13Z,16Z)/18:1(9Z)) C48H86NO8P HWRNDLGQJATPMI-IJJPCNHRSA-N -HMDB0008631 833.593455181 PC(22:4(7Z,10Z,13Z,16Z)/18:2(9Z,12Z)) C48H84NO8P MRTXALWCLLOFNU-RFGGSDOISA-N -HMDB0008635 865.656055437 PC(22:4(7Z,10Z,13Z,16Z)/20:0) C50H92NO8P MFAKYYBEUHGJJL-LFRGNPRBSA-N -HMDB0008636 863.640405373 PC(22:4(7Z,10Z,13Z,16Z)/20:1(11Z)) C50H90NO8P OWLGRGMPPSCQNS-IHOYWFMCSA-N -HMDB0008637 861.624755309 PC(22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z)) C50H88NO8P DSVRMAGYENFTLY-GDDYDVMSSA-N -HMDB0008652 793.598540559 PC(22:4(7Z,10Z,13Z,16Z)/P-16:0) C46H84NO7P QSCPZZNEQRYGTB-PZVMGWTJSA-N -HMDB0008653 821.629840687 PC(22:4(7Z,10Z,13Z,16Z)/P-18:0) C48H88NO7P HPVYKCPKEVVBSW-DDSLUFNQSA-N -HMDB0008654 819.614190623 PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) C48H86NO7P IWLBPHJZJWTKKU-DDURNVNNSA-N -HMDB0008655 819.614190623 PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(9Z)) C48H86NO7P JZDUVQDJNGETJN-ZHSBWYKVSA-N -HMDB0008656 779.546504989 PC(22:5(4Z,7Z,10Z,13Z,16Z)/14:0) C44H78NO8P AJLDCHCYUANNSO-WMUBFXSWSA-N -HMDB0008657 777.530854925 PC(22:5(4Z,7Z,10Z,13Z,16Z)/14:1(9Z)) C44H76NO8P XGLZBINKZRQAPD-OTMYLMJASA-N -HMDB0008659 807.577805117 PC(22:5(4Z,7Z,10Z,13Z,16Z)/16:0) C46H82NO8P BKMZEBCQEFQERC-RWWOECIPSA-N -HMDB0008660 805.562155053 PC(22:5(4Z,7Z,10Z,13Z,16Z)/16:1(9Z)) C46H80NO8P ZQVQZWAPLCJLRX-SCEKUSSYSA-N -HMDB0008661 835.609105245 PC(22:5(4Z,7Z,10Z,13Z,16Z)/18:0) C48H86NO8P QZWDHIKEFKIAGO-PPQSZTDQSA-N -HMDB0008662 833.593455181 PC(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(11Z)) C48H84NO8P IDZSNKUFNURDOS-MUNZJYBDSA-N -HMDB0008663 833.593455181 PC(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)) C48H84NO8P BMDGYQSEWGPUNB-ZOAQPGSISA-N -HMDB0008668 863.640405373 PC(22:5(4Z,7Z,10Z,13Z,16Z)/20:0) C50H90NO8P NFEZPFWTONOGNU-GDHSNESHSA-N -HMDB0008669 861.624755309 PC(22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)) C50H88NO8P GSPUWDQBHFMAQP-IVXDRBJVSA-N -HMDB0008685 791.582890495 PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-16:0) C46H82NO7P UXEPKPPWMGCZKG-MYZUPDLISA-N -HMDB0008686 819.614190623 PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:0) C48H86NO7P HZYIWJFVQCSBKE-SOTCHDEZSA-N -HMDB0008687 817.598540559 PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:1(11Z)) C48H84NO7P SJJGNKGNESOYIJ-WCGTXFODSA-N -HMDB0008688 817.598540559 PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:1(9Z)) C48H84NO7P MSCFBKZUOGKJNH-DOWYPDBQSA-N -HMDB0008689 779.546504989 PC(22:5(7Z,10Z,13Z,16Z,19Z)/14:0) C44H78NO8P LPZVTJRCWZIDNE-DYPKKMQZSA-N -HMDB0008690 777.530854925 PC(22:5(7Z,10Z,13Z,16Z,19Z)/14:1(9Z)) C44H76NO8P XYZGDARMQJBJAP-WKOATJLPSA-N -HMDB0008692 807.577805117 PC(22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C46H82NO8P ZEKZKKJDGPLPNX-WSRVZQLPSA-N -HMDB0008693 805.562155053 PC(22:5(7Z,10Z,13Z,16Z,19Z)/16:1(9Z)) C46H80NO8P XVZHRLZRCCOROP-CIWMBDKCSA-N -HMDB0008694 835.609105245 PC(22:5(7Z,10Z,13Z,16Z,19Z)/18:0) C48H86NO8P WRNCJRNSVGTWQJ-KEIGBYLJSA-N -HMDB0008695 833.593455181 PC(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(11Z)) C48H84NO8P ZMTZOGYHHRZBEB-VPPPPCJOSA-N -HMDB0008696 833.593455181 PC(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)) C48H84NO8P DQRVNAQGVZKEPS-BWZUDBBASA-N -HMDB0008701 863.640405373 PC(22:5(7Z,10Z,13Z,16Z,19Z)/20:0) C50H90NO8P PQDSIRFYBHSCGS-AJYQGTBASA-N -HMDB0008702 861.624755309 PC(22:5(7Z,10Z,13Z,16Z,19Z)/20:1(11Z)) C50H88NO8P OZHXZHXJMWKZQS-UBDQGBMGSA-N -HMDB0008718 791.582890495 PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-16:0) C46H82NO7P NJQMYYBEWKAWBA-QROROJFCSA-N -HMDB0008719 819.614190623 PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-18:0) C48H86NO7P KHICPJOTTBGGJP-LXZOKQGKSA-N -HMDB0008720 817.598540559 PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-18:1(11Z)) C48H84NO7P IBGYESWSWHJPKI-RXABMMRCSA-N -HMDB0008721 817.598540559 PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-18:1(9Z)) C48H84NO7P XUVCLJCZWPTAIO-OAKHYACESA-N -HMDB0008722 777.530854925 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:0) C44H76NO8P WJBQZCVRYZHPRT-VPDRWISVSA-N -HMDB0008725 805.562155053 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0) C46H80NO8P YALZVLCVXOASDL-FZGNBNATSA-N -HMDB0008727 833.593455181 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:0) C48H84NO8P AHWXJDWBIIDPKS-TZUVPVEASA-N -HMDB0008734 861.624755309 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:0) C50H88NO8P BINZSSJRRWYPEG-FODDTAATSA-N -HMDB0008751 789.567240431 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0) C46H80NO7P GJRXIEGNAMFGOV-VEOGPPBOSA-N -HMDB0008752 817.598540559 PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-18:0) C48H84NO7P FMBYBTSZVHUJMV-DIVFMYBRSA-N -HMDB0008755 817.656055437 PC(24:0/14:0) C46H92NO8P AOOITFXGGJDRQB-USYZEHPZSA-N -HMDB0008756 815.640405373 PC(24:0/14:1(9Z)) C46H90NO8P ARMWEMUEJRQZCD-KTKPPDABSA-N -HMDB0008758 845.687355565 PC(24:0/16:0) C48H96NO8P VNVBJTOZNQTTCV-YACUFSJGSA-N -HMDB0008759 843.671705501 PC(24:0/16:1(9Z)) C48H94NO8P VFARCRWDZSHCMO-VGURBHAXSA-N -HMDB0008760 873.718655693 PC(24:0/18:0) C50H100NO8P GFTINFYKXJTEDX-QSCHNALKSA-N -HMDB0008761 871.703005629 PC(24:0/18:1(11Z)) C50H98NO8P GHQRIAPHRZOTFN-IOVWWOAPSA-N -HMDB0008762 871.703005629 PC(24:0/18:1(9Z)) C50H98NO8P RPFJUYGHQKYVGN-FQUFUIAJSA-N -HMDB0008763 869.687355565 PC(24:0/18:2(9Z,12Z)) C50H96NO8P IIGQXTIUKKRHCT-WPYVRAPFSA-N -HMDB0008766 865.656055437 PC(24:0/18:4(6Z,9Z,12Z,15Z)) C50H92NO8P IETKDEZWCHUMKL-XVZQVVRQSA-N -HMDB0008784 829.692440943 PC(24:0/P-16:0) C48H96NO7P YUEYBAGQVGBAPR-SATDTQGDSA-N -HMDB0008785 857.723741071 PC(24:0/P-18:0) C50H100NO7P RGQRAIBRPXHXFR-BHYVKQBPSA-N -HMDB0008786 855.708091007 PC(24:0/P-18:1(11Z)) C50H98NO7P MWPRVEPTIHJPAL-KFEZRJJJSA-N -HMDB0008787 855.708091007 PC(24:0/P-18:1(9Z)) C50H98NO7P QALXUXWZWOUOFB-WIQZAVPASA-N -HMDB0008788 815.640405373 PC(24:1(15Z)/14:0) C46H90NO8P XWESAEXDQFDGEZ-IKJFKDIMSA-N -HMDB0008791 843.671705501 PC(24:1(15Z)/16:0) C48H94NO8P YXBYAKANNOWDGM-QFQSVWFISA-N -HMDB0008792 841.656055437 PC(24:1(15Z)/16:1(9Z)) C48H92NO8P ZHHDWDXQYDFYKQ-QYQAGSNQSA-N -HMDB0008793 871.703005629 PC(24:1(15Z)/18:0) C50H98NO8P NNYLDFXNPQLQLU-RURDTVAGSA-N -HMDB0008794 869.687355565 PC(24:1(15Z)/18:1(11Z)) C50H96NO8P NHCQXAIWNWQNKC-PRTODFFFSA-N -HMDB0008795 869.687355565 PC(24:1(15Z)/18:1(9Z)) C50H96NO8P RYDOABFPJPYSFY-JXSZFMCPSA-N -HMDB0008797 865.656055437 PC(24:1(15Z)/18:3(6Z,9Z,12Z)) C50H92NO8P GBIZLQLECZADGM-UDTGXXMFSA-N -HMDB0008798 865.656055437 PC(24:1(15Z)/18:3(9Z,12Z,15Z)) C50H92NO8P OENQWPYNVSKSGJ-XRNMTXJFSA-N -HMDB0008799 863.640405373 PC(24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C50H90NO8P HRIRUZYBOOMNNS-PLMDKBHUSA-N -HMDB0008817 827.676790879 PC(24:1(15Z)/P-16:0) C48H94NO7P LARCTGUWQQPWOV-QIWTVRBJSA-N -HMDB0008818 855.708091007 PC(24:1(15Z)/P-18:0) C50H98NO7P PGPURMZKEVWAFO-VMNSASLRSA-N -HMDB0008819 853.692440943 PC(24:1(15Z)/P-18:1(11Z)) C50H96NO7P XUCRMKOOPPYQFN-JFKFTMGCSA-N -HMDB0008820 853.692440943 PC(24:1(15Z)/P-18:1(9Z)) C50H96NO7P ZLQCRABYIDJNLT-AZPQEANBSA-N -HMDB0008824 663.483905216 PE(14:0/16:0) C35H70NO8P FXNACVVCWBVCGD-MGBGTMOVSA-N -HMDB0008826 691.515205345 PE(14:0/18:0) C37H74NO8P AUSLLMXXJBCZGL-PGUFJCEWSA-N -HMDB0008842 745.562155053 PE(14:0/22:1(13Z)) C41H80NO8P RETPVUGMYRRYPF-SGFDTVKUSA-N -HMDB0008843 743.546504989 PE(14:0/22:2(13Z,16Z)) C41H78NO8P OUEUPCHAIFZTKH-LSWZYRHBSA-N -HMDB0008849 773.593455181 PE(14:0/24:1(15Z)) C43H84NO8P PHNTZMYSEVOGFP-SJWLXQKBSA-N -HMDB0008874 745.562155053 PE(14:1(9Z)/22:0) C41H80NO8P BSVQKPRGDPWRBO-IQEWKVFESA-N -HMDB0008875 743.546504989 PE(14:1(9Z)/22:1(13Z)) C41H78NO8P CUUIBVDVVFLYGA-ZDMXYWDMSA-N -HMDB0008881 773.593455181 PE(14:1(9Z)/24:0) C43H84NO8P IPBXKYJWPCRPLD-AFHWQMSISA-N -HMDB0008882 771.577805117 PE(14:1(9Z)/24:1(15Z)) C43H82NO8P QHFLHJLJIVRZEW-KBELHWENSA-N -HMDB0008893 703.515204861 PE(15:0/18:1(11Z)) C38H74NO8P LKUKJIYAXQFZTD-MRDDHZETSA-N -HMDB0008894 703.515205345 PE(15:0/18:1(9Z)) C38H74NO8P ADCNXGARWPJRBV-UVCQAILXSA-N -HMDB0008900 731.546504989 PE(15:0/20:1(11Z)) C40H78NO8P DAZYZDVAACSMFA-DYFSFZQGSA-N -HMDB0008909 757.562155053 PE(15:0/22:2(13Z,16Z)) C42H80NO8P ZHZTYDTVUSPVLX-UQZFHPPLSA-N -HMDB0008923 691.515205345 PE(16:0/16:0) C37H74NO8P SLKDGVPOSSLUAI-PGUFJCEWSA-N -HMDB0008926 717.530855409 PE(16:0/18:1(11Z)) C39H76NO8P LYJWNHGFGVVCAO-IEHWZJNJSA-N -HMDB0008927 717.530855409 PE(16:0/18:1(9Z)) C39H76NO8P FHQVHHIBKUMWTI-OTMQOFQLSA-N -HMDB0008928 715.515204861 PE(16:0/18:2(9Z,12Z)) C39H74NO8P HBZNVZIRJWODIB-NHCUFCNUSA-N -HMDB0008933 745.562155053 PE(16:0/20:1(11Z)) C41H80NO8P CCIRMRKPMPEIFZ-WUOYJZDRSA-N -HMDB0008934 743.546504989 PE(16:0/20:2(11Z,14Z)) C41H78NO8P UDBXKKKIEXMSEA-XKKGNKCGSA-N -HMDB0008937 739.515204861 PE(16:0/20:4(5Z,8Z,11Z,14Z)) C41H74NO8P DRIVXEVMDWCWLI-CAQMIEAISA-N -HMDB0008938 739.515204861 PE(16:0/20:4(8Z,11Z,14Z,17Z)) C41H74NO8P NQIMLWFRWGTTOZ-JGGKAAGMSA-N -HMDB0008941 773.593455181 PE(16:0/22:1(13Z)) C43H84NO8P XMJSNHMFTISTET-AFASEBMKSA-N -HMDB0008942 771.577805117 PE(16:0/22:2(13Z,16Z)) C43H82NO8P OONVIPGPMOPRTM-PYPPRJKTSA-N -HMDB0008951 701.535940303 PE(16:0/P-18:1(11Z)) C39H76NO7P LAFTYABRLNPQHQ-NHGOJEJISA-N -HMDB0008952 701.535940303 PE(16:0/P-18:1(9Z)) C39H76NO7P FCPBFHHIKXPHHN-CSTBBDSDSA-N -HMDB0008956 689.49955528 PE(16:1(9Z)/16:0) C37H72NO8P QHNWICFFSBJICC-JUOLSMOWSA-N -HMDB0008965 745.562155053 PE(16:1(9Z)/20:0) C41H80NO8P DWDUPRRUGYDGQF-QRMPNUHKSA-N -HMDB0008966 743.546504989 PE(16:1(9Z)/20:1(11Z)) C41H78NO8P RPYIJSOTHVJLOR-HNNDRFCVSA-N -HMDB0008973 773.593455181 PE(16:1(9Z)/22:0) C43H84NO8P XUUQFFVLEYTYES-MITQYPHISA-N -HMDB0008974 771.577805117 PE(16:1(9Z)/22:1(13Z)) C43H82NO8P SMHQICHVYVREKX-CCUJVRBKSA-N -HMDB0008982 673.504640175 PE(16:1(9Z)/P-16:0) C37H72NO7P VNAHWIQCBOQKAJ-LSHIAAAISA-N -HMDB0008988 705.530854925 PE(18:0/15:0) C38H76NO8P CBJZKZNOFISZSC-PSXMRANNSA-N -HMDB0008992 745.562155053 PE(18:0/18:1(11Z)) C41H80NO8P ZBKSDVGXOOCETO-QRMPNUHKSA-N -HMDB0008993 745.562155538 PE(18:0/18:1(9Z)) C41H80NO8P JQKOHRZNEOQNJE-DJEJVYNPSA-N -HMDB0008994 743.546504989 PE(18:0/18:2(9Z,12Z)) C41H78NO8P YDTWOEYVDRKKCR-KNERPIHHSA-N -HMDB0008999 773.593455181 PE(18:0/20:1(11Z)) C43H84NO8P DBYSGBYABPVNGO-HVLKLTLRSA-N -HMDB0009000 771.577805117 PE(18:0/20:2(11Z,14Z)) C43H82NO8P WYDGEVICLIVPEG-JMMITYAOSA-N -HMDB0009009 795.577805117 PE(18:0/22:4(7Z,10Z,13Z,16Z)) C45H82NO8P HNFSZKRUPTYBOQ-ZDYOIFAYSA-N -HMDB0009010 793.562155053 PE(18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C45H80NO8P DPRXQVIZBLENFV-NPQRSGSQSA-N -HMDB0009011 793.562155053 PE(18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C45H80NO8P KYERVKWKQQBRQB-LKDUQXRXSA-N -HMDB0009017 729.567240431 PE(18:0/P-18:1(11Z)) C41H80NO7P XJRBLUARQNXNQS-CSASKLPHSA-N -HMDB0009018 729.567240431 PE(18:0/P-18:1(9Z)) C41H80NO7P ZTGVBXDPMCYOEV-KHFVPPDWSA-N -HMDB0009024 745.562155053 PE(18:1(11Z)/18:0) C41H80NO8P MKMUWJJSVUOCQC-DTKYWWSASA-N -HMDB0009025 743.546505474 PE(18:1(11Z)/18:1(11Z)) C41H78NO8P FXSMMNUNFDTUMS-NCDRPEBGSA-N -HMDB0009026 743.546504989 PE(18:1(11Z)/18:1(9Z)) C41H78NO8P VHHMKXOBDPAFKC-HWQBUQMOSA-N -HMDB0009031 773.593455181 PE(18:1(11Z)/20:0) C43H84NO8P HPHYBSPOEJMPAN-MITQYPHISA-N -HMDB0009032 771.577805117 PE(18:1(11Z)/20:1(11Z)) C43H82NO8P UKRAYYYOKQQQKZ-GMUXBFKVSA-N -HMDB0009042 793.562155053 PE(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C45H80NO8P OPJHRPGFKUCTOK-PXCLINIVSA-N -HMDB0009049 729.567240431 PE(18:1(11Z)/P-18:0) C41H80NO7P ANRCNDSZUNAAEU-SSTBVQCHSA-N -HMDB0009050 727.551590367 PE(18:1(11Z)/P-18:1(11Z)) C41H78NO7P BIYXBOGKCFGRKR-NZWMGPRYSA-N -HMDB0009051 727.551590367 PE(18:1(11Z)/P-18:1(9Z)) C41H78NO7P MTYMMKBRSNPIPR-UJUPZVJJSA-N -HMDB0009057 745.562155538 PE(18:1(9Z)/18:0) C41H80NO8P LICSIKXBSOVGBP-VEAYGOGPSA-N -HMDB0009058 743.546504989 PE(18:1(9Z)/18:1(11Z)) C41H78NO8P ZTSRQLQWGSDQGP-RTJYTIBZSA-N -HMDB0009059 743.546505474 PE(18:1(9Z)/18:1(9Z)) C41H78NO8P MWRBNPKJOOWZPW-NYVOMTAGSA-N -HMDB0009064 773.593455181 PE(18:1(9Z)/20:0) C43H84NO8P VOSQJLVNDRUECW-JHWHEROUSA-N -HMDB0009065 771.577805117 PE(18:1(9Z)/20:1(11Z)) C43H82NO8P UITCASPZWUAJBW-HLHBCVTMSA-N -HMDB0009075 793.562155053 PE(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C45H80NO8P IIWMKSHLSCQARO-DFVLQBLZSA-N -HMDB0009082 729.567240431 PE(18:1(9Z)/P-18:0) C41H80NO7P UJKZLJHORBRGNZ-QZEVRULJSA-N -HMDB0009083 727.551590367 PE(18:1(9Z)/P-18:1(11Z)) C41H78NO7P DZLWFPKMBZCBNP-LQNIOAHJSA-N -HMDB0009084 727.551590367 PE(18:1(9Z)/P-18:1(9Z)) C41H78NO7P ANVMSBIGOHYJFD-UDHSZFGOSA-N -HMDB0009090 743.546504989 PE(18:2(9Z,12Z)/18:0) C41H78NO8P DXXUYBAISOHOLM-XRIXOMQFSA-N -HMDB0009097 771.577805117 PE(18:2(9Z,12Z)/20:0) C43H82NO8P DPTUTWFSXXDMEO-CNBLIUODSA-N -HMDB0009107 795.577805117 PE(18:2(9Z,12Z)/22:2(13Z,16Z)) C45H82NO8P ODKCSLGCTVUPMX-JNUKZNIKSA-N -HMDB0009115 727.551590367 PE(18:2(9Z,12Z)/P-18:0) C41H78NO7P PTTOPPWTEHEDTA-PISDLAQISA-N -HMDB0009139 795.577805117 PE(18:3(6Z,9Z,12Z)/22:1(13Z)) C45H82NO8P JLYDNXJQTBLQKZ-WMEUQYBGSA-N -HMDB0009140 793.562155053 PE(18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C45H80NO8P GMXIUCLINHXQQD-VLLLCYRKSA-N -HMDB0009172 795.577805117 PE(18:3(9Z,12Z,15Z)/22:1(13Z)) C45H82NO8P DSZLDVIMYQKWGY-JOIVCNAYSA-N -HMDB0009173 793.562155053 PE(18:3(9Z,12Z,15Z)/22:2(13Z,16Z)) C45H80NO8P JNMLRFRSKRFHKL-QPBWJCTOSA-N -HMDB0009204 795.577805117 PE(18:4(6Z,9Z,12Z,15Z)/22:0) C45H82NO8P QCCKXFCODQEYIW-CEGLHCBSSA-N -HMDB0009205 793.562155053 PE(18:4(6Z,9Z,12Z,15Z)/22:1(13Z)) C45H80NO8P RQRUBEBOUYHPDW-HJVBBDAQSA-N -HMDB0009221 745.562155053 PE(20:0/16:1(9Z)) C41H80NO8P KZMQZJZTKYKTJQ-QRMPNUHKSA-N -HMDB0009223 773.593455181 PE(20:0/18:1(11Z)) C43H84NO8P XYHIPPZFNNOMQL-MITQYPHISA-N -HMDB0009224 773.593455181 PE(20:0/18:1(9Z)) C43H84NO8P VDNXNFMAFDYQSI-JHWHEROUSA-N -HMDB0009225 771.577805117 PE(20:0/18:2(9Z,12Z)) C43H82NO8P CLPMAPXZURYSNH-CNBLIUODSA-N -HMDB0009234 795.577805117 PE(20:0/20:4(5Z,8Z,11Z,14Z)) C45H82NO8P CIXWKDHTFXYVTC-LYPBNKOOSA-N -HMDB0009235 795.577805117 PE(20:0/20:4(8Z,11Z,14Z,17Z)) C45H82NO8P MIPOZDXFSKBSGM-IMYCSHPSSA-N -HMDB0009236 793.562155053 PE(20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C45H80NO8P MWDRGYRNYDLFKA-QAYGZBPNSA-N -HMDB0009248 757.598540559 PE(20:0/P-18:1(11Z)) C43H84NO7P UAPYZCDNFGJZSC-QSKLCZHJSA-N -HMDB0009249 757.598540559 PE(20:0/P-18:1(9Z)) C43H84NO7P KRZKEZVISPYOPJ-PFGXKIITSA-N -HMDB0009253 745.562155053 PE(20:1(11Z)/16:0) C41H80NO8P APTOFTJOCNPNQP-WUOYJZDRSA-N -HMDB0009254 743.546504989 PE(20:1(11Z)/16:1(9Z)) C41H78NO8P UBTNBSZLGQJLPI-HNNDRFCVSA-N -HMDB0009255 773.593455181 PE(20:1(11Z)/18:0) C43H84NO8P FMYXHSVUQFRMGW-HVLKLTLRSA-N -HMDB0009256 771.577805117 PE(20:1(11Z)/18:1(11Z)) C43H82NO8P GKXLKICEHUALBW-GMUXBFKVSA-N -HMDB0009257 771.577805117 PE(20:1(11Z)/18:1(9Z)) C43H82NO8P BUCLJVJCFFPNPB-HLHBCVTMSA-N -HMDB0009265 795.577805117 PE(20:1(11Z)/20:3(5Z,8Z,11Z)) C45H82NO8P FEPPCXIJSFVQDL-IKEWFQJZSA-N -HMDB0009266 795.577805117 PE(20:1(11Z)/20:3(8Z,11Z,14Z)) C45H82NO8P HHXLWNJDUZUKLO-RMVBIBMUSA-N -HMDB0009267 793.562155053 PE(20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C45H80NO8P VPDGQGZVNVFJGD-PCXMWBQASA-N -HMDB0009268 793.562155053 PE(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C45H80NO8P DVFTWBPPIMYUEN-QOPSJUFXSA-N -HMDB0009279 729.567240431 PE(20:1(11Z)/P-16:0) C41H80NO7P RZGFDECXQULSLM-KHFVPPDWSA-N -HMDB0009280 757.598540559 PE(20:1(11Z)/P-18:0) C43H84NO7P XEWZHCLDUCWNLB-HBHQMZOPSA-N -HMDB0009281 755.582890495 PE(20:1(11Z)/P-18:1(11Z)) C43H82NO7P OHBRNOPVIZLBBE-CGPNWZOFSA-N -HMDB0009282 755.582890495 PE(20:1(11Z)/P-18:1(9Z)) C43H82NO7P USEKWJQLASGHIH-WLKREVAWSA-N -HMDB0009286 743.546504989 PE(20:2(11Z,14Z)/16:0) C41H78NO8P NWJGEXWORFCRSI-XKKGNKCGSA-N -HMDB0009288 771.577805117 PE(20:2(11Z,14Z)/18:0) C43H82NO8P FRVWPWGGHGGKMD-JMMITYAOSA-N -HMDB0009297 795.577805117 PE(20:2(11Z,14Z)/20:2(11Z,14Z)) C45H82NO8P KSAJIJQUJUOZKJ-DHAKCBTASA-N -HMDB0009298 793.562155053 PE(20:2(11Z,14Z)/20:3(5Z,8Z,11Z)) C45H80NO8P HCQUFOLAJNWIDV-NQBPNILHSA-N -HMDB0009299 793.562155053 PE(20:2(11Z,14Z)/20:3(8Z,11Z,14Z)) C45H80NO8P JIEASZUPMDFVLW-WFGJNNQUSA-N -HMDB0009312 727.551590367 PE(20:2(11Z,14Z)/P-16:0) C41H78NO7P MPCVLWFEQHTFHH-YKKPZWMYSA-N -HMDB0009313 755.582890495 PE(20:2(11Z,14Z)/P-18:0) C43H82NO7P SSVPEUWHHFKSEB-IRSYNFPBSA-N -HMDB0009321 769.562155053 PE(20:3(5Z,8Z,11Z)/18:0) C43H80NO8P VFSMZSWKKPWQQW-SGLNQUQJSA-N -HMDB0009329 795.577805117 PE(20:3(5Z,8Z,11Z)/20:1(11Z)) C45H82NO8P RUOGJLKOZLGYHK-RFEVMYKHSA-N -HMDB0009330 793.562155053 PE(20:3(5Z,8Z,11Z)/20:2(11Z,14Z)) C45H80NO8P PYFNLOPDTZXGTN-FOCBNLSVSA-N -HMDB0009346 753.567240431 PE(20:3(5Z,8Z,11Z)/P-18:0) C43H80NO7P GOKCOIYNLBLTCL-FTHMHTRFSA-N -HMDB0009354 769.562155053 PE(20:3(8Z,11Z,14Z)/18:0) C43H80NO8P AYXGHIQPMDYMJC-AHMBLZLYSA-N -HMDB0009362 795.577805117 PE(20:3(8Z,11Z,14Z)/20:1(11Z)) C45H82NO8P CVPHRRKVQKYWSZ-TUMWYCLHSA-N -HMDB0009363 793.562155053 PE(20:3(8Z,11Z,14Z)/20:2(11Z,14Z)) C45H80NO8P BYVQCOREHGDXRD-WCABBIDISA-N -HMDB0009379 753.567240431 PE(20:3(8Z,11Z,14Z)/P-18:0) C43H80NO7P CWPKVJPBYGQUHE-MTROFRMRSA-N -HMDB0009387 767.546504989 PE(20:4(5Z,8Z,11Z,14Z)/18:0) C43H78NO8P FKCXXHSNNJJOHT-WKYUVXQZSA-N -HMDB0009394 795.577805117 PE(20:4(5Z,8Z,11Z,14Z)/20:0) C45H82NO8P WLTBPSUTBXIPBI-YCFXMPIKSA-N -HMDB0009395 793.562155053 PE(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)) C45H80NO8P BUIZMIHPZOBMLF-RXMGPZFASA-N -HMDB0009412 751.551590367 PE(20:4(5Z,8Z,11Z,14Z)/P-18:0) C43H78NO7P VZEYVZNRVARGGK-FXMFQVEGSA-N -HMDB0009420 767.546504989 PE(20:4(8Z,11Z,14Z,17Z)/18:0) C43H78NO8P JUYYWEDATPYDSS-FGIXMGIFSA-N -HMDB0009427 795.577805117 PE(20:4(8Z,11Z,14Z,17Z)/20:0) C45H82NO8P QIMXBAASHOXOCT-PUMRHJMJSA-N -HMDB0009428 793.562155053 PE(20:4(8Z,11Z,14Z,17Z)/20:1(11Z)) C45H80NO8P IZEJYRQAFUAOSD-APQWLYTDSA-N -HMDB0009445 751.551590367 PE(20:4(8Z,11Z,14Z,17Z)/P-18:0) C43H78NO7P ZRQPYJXAEPDRDM-VZBWJDOASA-N -HMDB0009460 793.562155053 PE(20:5(5Z,8Z,11Z,14Z,17Z)/20:0) C45H80NO8P HDCWJEDGPFQUKG-BUWHGKJASA-N -HMDB0009482 745.562155053 PE(22:0/14:1(9Z)) C41H80NO8P QMQLZZVQOMZDCN-IQEWKVFESA-N -HMDB0009485 773.593455181 PE(22:0/16:1(9Z)) C43H84NO8P ZNMZYHOEYPCVMP-MITQYPHISA-N -HMDB0009492 795.577805117 PE(22:0/18:4(6Z,9Z,12Z,15Z)) C45H82NO8P QCPNXDHEZUMTLB-OYRCKGISSA-N -HMDB0009514 745.562155053 PE(22:1(13Z)/14:0) C41H80NO8P AHVVIUYIKIQVDO-SGFDTVKUSA-N -HMDB0009515 743.546504989 PE(22:1(13Z)/14:1(9Z)) C41H78NO8P XOTZQQUUCAOSLB-ZDMXYWDMSA-N -HMDB0009517 773.593455181 PE(22:1(13Z)/16:0) C43H84NO8P URRUJVMBYGYWNL-AFASEBMKSA-N -HMDB0009518 771.577805117 PE(22:1(13Z)/16:1(9Z)) C43H82NO8P CUUQTWOJYKCYRS-CCUJVRBKSA-N -HMDB0009523 795.577805117 PE(22:1(13Z)/18:3(6Z,9Z,12Z)) C45H82NO8P RHBZSPYYUTVJHJ-HPHYLAMISA-N -HMDB0009524 795.577805117 PE(22:1(13Z)/18:3(9Z,12Z,15Z)) C45H82NO8P YHKHZYNNNXVJRS-JOIVCNAYSA-N -HMDB0009525 793.562155053 PE(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C45H80NO8P IZWPZNGYCMMGHU-IYGLDYEKSA-N -HMDB0009543 757.598540559 PE(22:1(13Z)/P-16:0) C43H84NO7P MVASPAIFCLTHSN-HBHQMZOPSA-N -HMDB0009547 743.546504989 PE(22:2(13Z,16Z)/14:0) C41H78NO8P XJLGATDALCZXFX-LSWZYRHBSA-N -HMDB0009549 757.562155053 PE(22:2(13Z,16Z)/15:0) C42H80NO8P KXVQBSORIXQSRP-UQZFHPPLSA-N -HMDB0009550 771.577805117 PE(22:2(13Z,16Z)/16:0) C43H82NO8P XNZHFYSLNIZKJP-PYPPRJKTSA-N -HMDB0009555 795.577805117 PE(22:2(13Z,16Z)/18:2(9Z,12Z)) C45H82NO8P JCZXAXBRLLOCPM-JNUKZNIKSA-N -HMDB0009556 793.562155053 PE(22:2(13Z,16Z)/18:3(6Z,9Z,12Z)) C45H80NO8P BRZHNCZGBULDIZ-XYHFPQPRSA-N -HMDB0009557 793.562155053 PE(22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C45H80NO8P QISXRGLAZUIPCG-QPBWJCTOSA-N -HMDB0009576 755.582890495 PE(22:2(13Z,16Z)/P-16:0) C43H82NO7P WMGNZOBBKTUGGQ-IRSYNFPBSA-N -HMDB0009585 795.577805117 PE(22:4(7Z,10Z,13Z,16Z)/18:0) C45H82NO8P WALILJXJZOCRCD-LFKCOKBZSA-N -HMDB0009586 793.562155053 PE(22:4(7Z,10Z,13Z,16Z)/18:1(11Z)) C45H80NO8P SQWAGNNCWNPIQG-UDSQKQMUSA-N -HMDB0009587 793.562155053 PE(22:4(7Z,10Z,13Z,16Z)/18:1(9Z)) C45H80NO8P PQCDVFVOQBZXJA-BYQCZQGLSA-N -HMDB0009610 779.582890495 PE(22:4(7Z,10Z,13Z,16Z)/P-18:0) C45H82NO7P OJCHOVMLEHFBOD-IKHSQHJKSA-N -HMDB0009611 777.567240431 PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) C45H80NO7P FISVEBQJGBZOPW-USOCFQKQSA-N -HMDB0009612 777.567240431 PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(9Z)) C45H80NO7P PIRVOZHXFFFFFG-ZGMVDJDGSA-N -HMDB0009618 793.562155053 PE(22:5(4Z,7Z,10Z,13Z,16Z)/18:0) C45H80NO8P NCWMYSRFLUIVBC-LDCZMAMRSA-N -HMDB0009643 777.567240431 PE(22:5(4Z,7Z,10Z,13Z,16Z)/P-18:0) C45H80NO7P PCKXGFCVDCVIHH-ABYSKWQHSA-N -HMDB0009651 793.562155053 PE(22:5(7Z,10Z,13Z,16Z,19Z)/18:0) C45H80NO8P WQHSMYBPCGOJLV-LMAJKDESSA-N -HMDB0009676 777.567240431 PE(22:5(7Z,10Z,13Z,16Z,19Z)/P-18:0) C45H80NO7P DHZUMZVZAZYQIW-MVCMTJSTSA-N -HMDB0009713 773.593455181 PE(24:0/14:1(9Z)) C43H84NO8P UJDHYDGXZXDWNT-AFHWQMSISA-N -HMDB0009739 915.765605885 PE(24:0/24:0) C53H106NO8P BZUNRSOACSOEBT-NLXJDERGSA-N -HMDB0009740 913.749955821 PE(24:0/24:1(15Z)) C53H104NO8P MTYZXHQAIRJTJM-PVKRUZGSSA-N -HMDB0009745 773.593455181 PE(24:1(15Z)/14:0) C43H84NO8P HNZTVXMGKFBWNB-SJWLXQKBSA-N -HMDB0009746 771.577805117 PE(24:1(15Z)/14:1(9Z)) C43H82NO8P LYQNHUUXGYHXPH-KBELHWENSA-N -HMDB0009778 810.525829126 PI(16:0/16:0) C41H79O13P IBUKXRINTKQBRQ-NBURIUCMSA-N -HMDB0009789 858.525829126 PI(16:0/20:4(5Z,8Z,11Z,14Z)) C45H79O13P KIQYUSYSJTUGFZ-GWAZTMTOSA-N -HMDB0009790 858.525829126 PI(16:0/20:4(8Z,11Z,14Z,17Z)) C45H79O13P VWRYMIZQLPXULA-CRQXIUBQSA-N -HMDB0009795 884.54147919 PI(16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C47H81O13P HNDKJAKTGIPBNM-YTQFFZBCSA-N -HMDB0009796 884.54147919 PI(16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C47H81O13P COCGWLCGPZONJF-DDAFQYKVSA-N -HMDB0009804 884.54147919 PI(16:2(9Z,12Z)/22:3(10Z,13Z,16Z)) C47H81O13P DMWGXPQFZLCNSP-LVRSVQNSSA-N -HMDB0009806 836.54147919 PI(18:0/16:1(9Z)) C43H81O13P QMAMEGDTQPWOEM-FVTXIWCXSA-N -HMDB0009812 890.588429382 PI(18:0/20:2(11Z,14Z)) C47H87O13P RZFIPFIGUWXYNB-LFAJGPILSA-N -HMDB0009813 888.572779318 PI(18:0/20:3(5Z,8Z,11Z)) C47H85O13P BSTMJEKBGMABBW-SVOBYVNYSA-N -HMDB0009814 888.572779318 PI(18:0/20:3(8Z,11Z,14Z)) C47H85O13P ZUGLBBVIAIBIKG-JOXDCNDISA-N -HMDB0009815 886.557129254 PI(18:0/20:4(5Z,8Z,11Z,14Z)) C47H83O13P KRTOMQDUKGRFDJ-MWZLTEOLSA-N -HMDB0009816 886.557129254 PI(18:0/20:4(8Z,11Z,14Z,17Z)) C47H83O13P OJESNYFIPWSOPO-MTPIFTEDSA-N -HMDB0009823 834.525829126 PI(18:1(11Z)/16:1(9Z)) C43H79O13P OFWQGVZVLYOZNF-IZGNVWOTSA-N -HMDB0009824 862.557129254 PI(18:1(11Z)/18:1(11Z)) C45H83O13P HJXLLSHIQZPQLZ-BESHNSGQSA-N -HMDB0009825 862.557129254 PI(18:1(11Z)/18:1(9Z)) C45H83O13P FTAJUMMOKVEZBE-BPSMPOADSA-N -HMDB0009827 858.525829126 PI(18:1(11Z)/18:3(6Z,9Z,12Z)) C45H79O13P IMEOCGXNCGMQIG-QQXGMZICSA-N -HMDB0009828 858.525829126 PI(18:1(11Z)/18:3(9Z,12Z,15Z)) C45H79O13P XOCJWQRCSPVKML-XDPJAJCUSA-N -HMDB0009832 884.54147919 PI(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C47H81O13P SSZPKZKUQCKMKS-YDHZRSOTSA-N -HMDB0009833 884.54147919 PI(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C47H81O13P HKZUQGZNSPCSAQ-JRRRANSLSA-N -HMDB0009835 834.525829126 PI(18:1(9Z)/16:1(9Z)) C43H79O13P BDRPKQLVISVUCU-UZBWDOCNSA-N -HMDB0009836 862.557129254 PI(18:1(9Z)/18:1(11Z)) C45H83O13P LORSZBNSYOKZNV-RCVIVVFUSA-N -HMDB0009837 862.557129254 PI(18:1(9Z)/18:1(9Z)) C45H83O13P LALGUHSIWLNTNW-SHLWDWSJSA-N -HMDB0009839 858.525829126 PI(18:1(9Z)/18:3(6Z,9Z,12Z)) C45H79O13P QQQIZZJWFPGZFU-XZJTVJSISA-N -HMDB0009840 858.525829126 PI(18:1(9Z)/18:3(9Z,12Z,15Z)) C45H79O13P GOWNAKLKHNFBLL-UJAKPBMDSA-N -HMDB0009844 884.54147919 PI(18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C47H81O13P SHIZRFSRTKXRQL-VKUXDMFFSA-N -HMDB0009845 884.54147919 PI(18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C47H81O13P XGZVRASBCZTHNO-QJXGYZSMSA-N -HMDB0009850 858.525829126 PI(18:2(9Z,12Z)/18:2(9Z,12Z)) C45H79O13P JTPRPYYVVJBCFF-IULBOROHSA-N -HMDB0009854 884.54147919 PI(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)) C47H81O13P CQDXWSUINUWFQX-XESSABTASA-N -HMDB0009855 884.54147919 PI(18:2(9Z,12Z)/20:3(8Z,11Z,14Z)) C47H81O13P WMVAOBOFQHVKTL-VEAQMIGASA-N -HMDB0009859 858.525829126 PI(18:3(6Z,9Z,12Z)/18:1(11Z)) C45H79O13P YLTYXLLWSZWHST-WCAHMIBUSA-N -HMDB0009860 858.525829126 PI(18:3(6Z,9Z,12Z)/18:1(9Z)) C45H79O13P XPAIWNCWEZBRLN-HWUJAIKYSA-N -HMDB0009863 858.525829126 PI(18:3(9Z,12Z,15Z)/18:1(11Z)) C45H79O13P QABXOBXYNADSMS-FINYZNFOSA-N -HMDB0009864 858.525829126 PI(18:3(9Z,12Z,15Z)/18:1(9Z)) C45H79O13P CIBWCGFXPGNENM-BVAWILIRSA-N -HMDB0009883 884.54147919 PI(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C47H81O13P LFLTUEYGXIOFMJ-UBPNAFHNSA-N -HMDB0009890 884.54147919 PI(20:3(8Z,11Z,14Z)/18:2(9Z,12Z)) C47H81O13P QZQRJBQFCRWEDG-CCTXZGAHSA-N -HMDB0009893 858.525829126 PI(20:4(5Z,8Z,11Z,14Z)/16:0) C45H79O13P WPXXYOUAQYYXER-BFRKKRKTSA-N -HMDB0009895 884.54147919 PI(20:4(5Z,8Z,11Z,14Z)/18:1(11Z)) C47H81O13P ZNKMZGVZAZCFHT-JAGYCSJCSA-N -HMDB0009896 884.54147919 PI(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) C47H81O13P WDEXQPPLSHRNLR-ZGNZFFCSSA-N -HMDB0009899 858.525829126 PI(20:4(8Z,11Z,14Z,17Z)/16:0) C45H79O13P LPQVHUAOGUAQEW-CRQXIUBQSA-N -HMDB0009901 884.54147919 PI(20:4(8Z,11Z,14Z,17Z)/18:1(11Z)) C47H81O13P VIGFKXLWKPBIQI-PJZWFLMOSA-N -HMDB0009902 884.54147919 PI(20:4(8Z,11Z,14Z,17Z)/18:1(9Z)) C47H81O13P AQKOQLPXFXZLKF-WNCVJLDNSA-N -HMDB0009908 884.54147919 PI(22:3(10Z,13Z,16Z)/16:2(9Z,12Z)) C47H81O13P QRJDLXBDGZQKAL-LVRSVQNSSA-N -HMDB0009916 884.54147919 PI(22:5(4Z,7Z,10Z,13Z,16Z)/16:0) C47H81O13P RQOVEBMFWCAUPR-RTEDXGKZSA-N -HMDB0009918 884.54147919 PI(22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C47H81O13P YNZSTCIWFMYXJU-XDOZVXPWSA-N -HMDB0010165 811.536334233 PS(18:0/20:4(8Z,11Z,14Z,17Z)) C44H78NO10P IULWELDCBXQXED-DWOSIAKHSA-N -HMDB0010168 705.591049878 SM(d18:0/16:0) C39H82N2O6P QHZIGNLCLJPLCU-QPPIDDCLSA-O -HMDB0010169 703.575399814 SM(d18:1/16:0) C39H80N2O6P RWKUXQNLWDTSLO-GWQJGLRPSA-O -HMDB0010223 296.23514489 9-HODE C18H32O3 NPDSHTNEKLQQIJ-SIGMCMEVSA-N -HMDB0010316 327.095416525 "Acetaminophen glucuronide" C14H17NO8 IPROLSVTVHAQLE-BYNIDDHOSA-N -HMDB0010325 222.073952802 "Ethyl glucuronide" C8H14O7 IWJBVMJWSPZNJH-UQGZVRACSA-N -HMDB0010340 462.26175357 "Retinyl beta-glucuronide" C26H38O7 IYHVRAMISWFIRU-GMBUFXMQSA-N -HMDB0010378 306.255880332 "5,8,11-Eicosatrienoic acid " C20H34O2 UNSRRHDPHVZAHH-YOILPLPUSA-N -HMDB0010379 467.301189343 LysoPC(14:0/0:0) C22H46NO7P VXUOFDJKYGDUJI-OAQYLSRUSA-N -HMDB0010382 495.332489471 LysoPC(16:0) C24H50NO7P ASWBNKHCZGQVJV-HSZRJFAPSA-N -HMDB0010383 493.316839407 LysoPC(16:1(9Z)/0:0) C24H48NO7P LFUDDCMNKWEORN-ZXEGGCGDSA-N -HMDB0010384 523.363789599 LysoPC(18:0) C26H54NO7P IHNKQIMGVNPMTC-RUZDIDTESA-N -HMDB0010385 521.348139535 LysoPC(18:1(11Z)) C26H52NO7P PZRFVAHZNWPPAC-VBKSFVIKSA-N -HMDB0010386 519.332489471 LysoPC(18:2(9Z,12Z)) C26H50NO7P SPJFYYJXNPEZDW-FTJOPAKQSA-N -HMDB0010393 545.348139535 LysoPC(20:3(5Z,8Z,11Z)) C28H52NO7P YHGXYYIGHBPDMX-BUTFDPNWSA-N -HMDB0010394 545.348139535 LysoPC(20:3(8Z,11Z,14Z)) C28H52NO7P BBNHCUBQEQJHIG-FZZJNMCHSA-N -HMDB0010395 543.332489471 LysoPC(20:4(5Z,8Z,11Z,14Z)) C28H50NO7P LAXQYRRMGGEGOH-JXRLJXCWSA-N -HMDB0010396 543.332489471 LysoPC(20:4(8Z,11Z,14Z,17Z)) C28H50NO7P GOMVPVRDBLLHQC-VEJNOCSESA-N -HMDB0010405 607.457689983 LysoPC(24:0) C32H66NO7P SKJMUADLQLZAGH-WJOKGBTCSA-N -HMDB0010408 505.353224913 LysoPC(P-18:1(9Z)) C26H52NO6P KJUNGQXFZYMUOH-FKWLWHCOSA-N -HMDB0010411 778.70504074 TG(16:0/14:0/16:0) C49H94O6 NSQZMMPMMBEIIA-UHFFFAOYSA-N -HMDB0010412 776.689390682 TG(16:0/14:0/16:1(9Z)) C49H92O6 VUYXIQLBLBPRDY-VOHILQMLSA-N -HMDB0010416 832.75199094 TG(16:0/16:0/18:1(11Z)) C53H100O6 ZKEWGTVAIGJNBK-ZMSSUMMHSA-N -HMDB0010419 774.673740612 TG(16:1(9Z)/14:0/16:1(9Z)) C49H90O6 LGZSJHAMIMLPBP-IKJQKJQYSA-N -HMDB0010432 856.75199094 TG(18:0/16:0/18:3(9Z,12Z,15Z)) C55H100O6 GRVGSTWBCPVINB-KORYJFEASA-N -HMDB0010433 888.814591198 TG(18:0/18:0/18:1(11Z)) C57H108O6 CXVKBFLPGNGMQW-NAWMRHBJSA-N -HMDB0010439 856.75199094 TG(18:1(11Z)/16:0/18:2(9Z,12Z)) C55H100O6 CKVYPEYQBVKVNX-PVTXHSMZSA-N -HMDB0010441 880.75199094 TG(18:1(11Z)/16:0/20:4(5Z,8Z,11Z,14Z)) C57H100O6 MZKZFZRBZNYKEI-OJPGLQQHSA-N -HMDB0010442 856.751990932 TG(18:1(11Z)/16:1(9Z)/18:1(11Z)) C55H100O6 BDCYUJLSXCABLJ-BUTYCLJRSA-N -HMDB0010443 856.75199094 TG(18:1(11Z)/16:1(9Z)/18:1(9Z)) C55H100O6 OGWGRVYSSZTIHF-GDLLXJMDSA-N -HMDB0010447 884.783291069 TG(18:1(11Z)/18:0/18:2(9Z,12Z)) C57H104O6 IBHXNCOURWRZLX-BDGWNPADSA-N -HMDB0010450 852.720690811 TG(18:1(9Z)/14:0/20:4(5Z,8Z,11Z,14Z)) C55H96O6 JBTFUWBVCCYOPB-RVHDJDADSA-N -HMDB0010452 884.783291069 TG(18:1(9Z)/16:0/20:2(11Z,14Z)) C57H104O6 TYPSCZYHWXUNQD-HLYOSYIHSA-N -HMDB0010456 882.767641004 TG(18:1(9Z)/18:0/18:3(9Z,12Z,15Z)) C57H102O6 AJZXAAFSXUMAJT-KZWILNJASA-N -HMDB0010457 884.78329106 TG(18:1(9Z)/18:1(11Z)/18:1(9Z)) C57H104O6 VCOQISMTLHMNRY-HGKIKGFLSA-N -HMDB0010458 882.767641004 TG(18:1(9Z)/18:1(11Z)/18:2(9Z,12Z)) C57H102O6 DSCHILLYKXFUMK-KJCLFLEFSA-N -HMDB0010459 880.75199094 TG(18:1(9Z)/18:1(9Z)/18:3(6Z,9Z,12Z)) C57H100O6 GOEUQPTVSLNGLY-BFAXNOOESA-N -HMDB0010460 880.75199094 TG(18:1(9Z)/18:1(9Z)/18:3(9Z,12Z,15Z)) C57H100O6 OEJXMJPFOHYSIU-KXOAOTBFSA-N -HMDB0010466 940.845891326 TG(18:1(9Z)/18:1(9Z)/22:1(13Z)) C61H112O6 TUJAWJCRCOOMQU-GERDQFRXSA-N -HMDB0010473 852.720690811 TG(18:2(9Z,12Z)/16:0/18:3(9Z,12Z,15Z)) C55H96O6 VFDCLCMTXUEIHM-QCSLZTMBSA-N -HMDB0010474 882.767641004 TG(18:2(9Z,12Z)/16:0/20:2(11Z,14Z)) C57H102O6 HYPYKVIIWHXPAS-BIBJHKLQSA-N -HMDB0010477 880.75199094 TG(18:2(9Z,12Z)/18:0/18:3(9Z,12Z,15Z)) C57H100O6 RRAQCLWYZXSZBE-WGGYTBCTSA-N -HMDB0010479 880.751990932 TG(18:2(9Z,12Z)/18:1(11Z)/18:2(9Z,12Z)) C57H100O6 YJBUODNAHDVYLJ-LNZLXKATSA-N -HMDB0010487 930.767641004 TG(18:2(9Z,12Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H102O6 BHZWQMNOYPGDNF-NZGDLCEJSA-N -HMDB0010488 928.75199094 TG(18:2(9Z,12Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H100O6 DIVFDZQIIPHWJN-VOCNDMGLSA-N -HMDB0010493 900.720690811 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 ADLPFNWYXJKFQW-OEYGRNRFSA-N -HMDB0010500 900.720690811 TG(18:3(9Z,12Z,15Z)/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 JKKJXOPBDBRBKU-MYMFMJOCSA-N -HMDB0010504 900.720690811 TG(18:3(9Z,12Z,15Z)/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 KSUDLITWNAQVCF-NIIDFXJZSA-N -HMDB0010510 924.720690811 TG(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 ACBQPKXRQKGWDK-AXYZTWSQSA-N -HMDB0010511 924.720690811 TG(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 CUDUJMHSCIYKFW-VEIXBFFSSA-N -HMDB0010525 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 JEQMHFPQVKBLLQ-RCKJRCKSSA-N -HMDB0010526 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 PEWDINSOXAERHQ-HBNDJVCZSA-N -HMDB0010527 900.720690811 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C59H96O6 DWUCTGPOYZTRAA-DJKQXZPISA-N -HMDB0010528 924.720690811 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 NHGBUKYRNKUYSP-SRYGDWGVSA-N -HMDB0010529 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 AKOYMLIOOBZSET-IXDBBCEUSA-N -HMDB0010531 924.720690811 TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/18:3(9Z,12Z,15Z)) C61H96O6 SPDHJCJAJYRMFV-LBIHDVJCSA-N -HMDB0010532 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 BOXFBDURIZMSKQ-MZNDNNEASA-N -HMDB0010533 924.720690804 TG(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 KWSQCBUVZQFFAT-FIMKYDFISA-N -HMDB0010534 952.75199094 TG(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 HUAVJWUSPIMCRO-QIYBODIWSA-N -HMDB0010542 954.767640996 TG(22:5(7Z,10Z,13Z,16Z,19Z)/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 PTTJPMSHTWJLSB-NJWNTHTESA-N -HMDB0010543 952.75199094 TG(22:5(7Z,10Z,13Z,16Z,19Z)/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 MDADRLWXQATSON-QHMMTQDXSA-N -HMDB0010544 980.78329106 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 XRIGAJUVDRNXQG-CRBSXKCRSA-N -HMDB0010545 978.767641004 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 PKSYBCOQZZXUCU-UIKKEMKKSA-N -HMDB0010546 978.767640996 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 ZUNWODIBMWYUGB-SQSZVPJQSA-N -HMDB0010547 976.75199094 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 NZZPEUWLSFJAKQ-MPPUJSLMSA-N -HMDB0010548 976.751990932 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 CJLFAMUPGLSRFA-YWULFENESA-N -HMDB0010549 974.736340876 TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 HWXPLSJBUFNUQA-BQADEHQOSA-N -HMDB0010556 978.767640996 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 SBPDLKMUDWDEFF-KGAICMFLSA-N -HMDB0010557 974.736340868 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 MEIOXTFWWGQLIM-YWAUJEJGSA-N -HMDB0010562 1022.736340876 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C69H98O6 SOFMPBOQLPVEQZ-IGLCCECBSA-N -HMDB0010570 722.509785613 PG(16:0/16:0) C38H75O10P BIABMEZBCHDPBV-MPQUPPDSSA-N -HMDB0010571 720.494135068 PG(16:0/16:1(9Z)) C38H73O10P NOFOTAHTYLXZNV-DCQLZOMZSA-N -HMDB0010573 748.525435196 PG(16:0/18:1(11Z)) C40H77O10P ADYWCMPUNIVOEA-GPJPVTGXSA-N -HMDB0010574 748.525435196 PG(16:0/18:1(9Z)) C40H77O10P PAZGBAOHGQRCBP-HGWHEPCSSA-N -HMDB0010576 744.494135068 PG(16:0/18:3(6Z,9Z,12Z)) C40H73O10P MVHBCRUZHMRQHX-UIWSMAGISA-N -HMDB0010578 772.525435196 PG(16:0/20:3(5Z,8Z,11Z)) C42H77O10P NDGDVGUDTIGKCF-PSQQFKKASA-N -HMDB0010579 772.525435196 PG(16:0/20:3(8Z,11Z,14Z)) C42H77O10P YQISKVDQGRCZBE-WQQWEMLQSA-N -HMDB0010580 770.509785132 PG(16:0/20:4(5Z,8Z,11Z,14Z)) C42H75O10P FBAPNCMXWMGHJY-NYWCEQGFSA-N -HMDB0010593 770.509785132 PG(16:1(9Z)/20:3(5Z,8Z,11Z)) C42H75O10P VWDLPQNBLHJJIU-OILVUHFKSA-N -HMDB0010594 770.509785132 PG(16:1(9Z)/20:3(8Z,11Z,14Z)) C42H75O10P SSJULPPOBKUTHM-MXRJECHTSA-N -HMDB0010605 774.54108526 PG(18:0/18:2(9Z,12Z)) C42H79O10P JPRWHUSRRGNLOV-KKUBIFFLSA-N -HMDB0010606 772.525435196 PG(18:0/18:3(6Z,9Z,12Z)) C42H77O10P AQIAGGRCCDLKEY-MUJLYBRFSA-N -HMDB0010607 772.525435196 PG(18:0/18:3(9Z,12Z,15Z)) C42H77O10P NWLZWBTUOZAKQE-MWIPVWBPSA-N -HMDB0010617 776.556735324 PG(18:1(11Z)/18:0) C42H81O10P HSJNITDXQQDYMJ-KZUSSCLUSA-N -HMDB0010618 774.541085742 PG(18:1(11Z)/18:1(11Z)) C42H79O10P SOLXJHKVRWSNJX-HKFASTTNSA-N -HMDB0010619 774.54108526 PG(18:1(11Z)/18:1(9Z)) C42H79O10P MANUXINXZIXGSR-ZRXIRQNBSA-N -HMDB0010620 772.525435196 PG(18:1(11Z)/18:2(9Z,12Z)) C42H77O10P MFMFDUSGTGUBKM-YRUDZPEDSA-N -HMDB0010621 770.509785132 PG(18:1(11Z)/18:3(6Z,9Z,12Z)) C42H75O10P VSRGIKGINQIKBO-FJNFSWOHSA-N -HMDB0010622 770.509785132 PG(18:1(11Z)/18:3(9Z,12Z,15Z)) C42H75O10P QUMYVZXTAFJZPC-KEXKQFALSA-N -HMDB0010629 820.525435196 PG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H77O10P TZGMUGQUTJEGJC-SMHLWGDZSA-N -HMDB0010632 776.556735324 PG(18:1(9Z)/18:0) C42H81O10P URDBSUCIYKJPCG-INSSKLQOSA-N -HMDB0010633 774.54108526 PG(18:1(9Z)/18:1(11Z)) C42H79O10P NTMBJQYQYMPGRM-MYVKIHSOSA-N -HMDB0010634 774.541085742 PG(18:1(9Z)/18:1(9Z)) C42H79O10P DSNRWDQKZIEDDB-SQYFZQSCSA-N -HMDB0010635 772.525435196 PG(18:1(9Z)/18:2(9Z,12Z)) C42H77O10P FSVTVWTVWNNIQX-MODZKLJDSA-N -HMDB0010636 770.509785132 PG(18:1(9Z)/18:3(6Z,9Z,12Z)) C42H75O10P DZFSSBHYSJDYFN-MNHFJEBCSA-N -HMDB0010637 770.509785132 PG(18:1(9Z)/18:3(9Z,12Z,15Z)) C42H75O10P SPLOPJJVMQWFIT-SILBTBCMSA-N -HMDB0010644 820.525435196 PG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H77O10P FZJRPYWBMGYDIA-JJTNLPPNSA-N -HMDB0010648 772.525435196 PG(18:2(9Z,12Z)/18:1(11Z)) C42H77O10P ILTZKQRTHXYCKE-GZPSIAITSA-N -HMDB0010649 772.525435196 PG(18:2(9Z,12Z)/18:1(9Z)) C42H77O10P KBDCFYFMQOAHAN-WUQMUQDBSA-N -HMDB0010650 770.509785132 PG(18:2(9Z,12Z)/18:2(9Z,12Z)) C42H75O10P AKWGRDPPGYFWIW-IYYSTRLISA-N -HMDB0010657 820.525435196 PG(18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C46H77O10P YVYIXWADRITLPA-VNPFHBCQSA-N -HMDB0010658 820.525435196 PG(18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C46H77O10P LOQVZAVLOYOOSB-GQEJPCSQSA-N -HMDB0010662 772.525435196 PG(18:3(6Z,9Z,12Z)/18:0) C42H77O10P ZQADGDHEOYNPBN-VLJMGXKQSA-N -HMDB0010663 770.509785132 PG(18:3(6Z,9Z,12Z)/18:1(11Z)) C42H75O10P PDVQNXBAJRBGOS-PCIHCSGPSA-N -HMDB0010664 770.509785132 PG(18:3(6Z,9Z,12Z)/18:1(9Z)) C42H75O10P ABTXGGZXXIHNDW-QLADQEJGSA-N -HMDB0010671 820.525435196 PG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C46H77O10P FCDCKTDFYQEOAD-YQPREKOFSA-N -HMDB0010677 772.525435196 PG(18:3(9Z,12Z,15Z)/18:0) C42H77O10P VMDKDWGHMZQSLV-ZOIXFCGWSA-N -HMDB0010678 770.509785132 PG(18:3(9Z,12Z,15Z)/18:1(11Z)) C42H75O10P UVTOMLLPZLIQLX-NHQSCMECSA-N -HMDB0010679 770.509785132 PG(18:3(9Z,12Z,15Z)/18:1(9Z)) C42H75O10P JOAKZDPNBIREMY-ZKYOWWIASA-N -HMDB0010686 820.525435196 PG(18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C46H77O10P ZACXWNLBOWEKJK-YDYSYWMXSA-N -HMDB0010697 555.522659701 Cer(t18:0/16:0) C34H69NO4 IVBULNXGVIHEKN-AUOMWKRBSA-N -HMDB0010730 242.188194698 "3-Oxotetradecanoic acid" C14H26O3 XLKOZYOVXNPWGT-UHFFFAOYSA-N -HMDB0010738 166.049075456 1-Methylxanthine C6H6N4O2 MVOYJPOZRLFTCP-UHFFFAOYSA-N -HMDB0011103 196.059640142 "1,7-Dimethyluric acid" C7H8N4O3 NOFNCLGCUJJPKU-UHFFFAOYSA-N -HMDB0011105 226.070204828 5-Acetylamino-6-formylamino-3-methyluracil C8H10N4O4 RDZNZFGKEVDNPK-UHFFFAOYSA-N -HMDB0011107 182.043990078 "7-Methyluric acid" C6H6N4O3 YHNNPKUFPWLTOP-UHFFFAOYSA-N -HMDB0011130 481.316839407 LysoPE(18:0/0:0) C23H48NO7P BBYWOYAFBUOUFP-JOCHJYFZSA-N -HMDB0011131 358.308309832 MG(18:0/0:0/0:0) C21H42O4 VBICKXHEKHSIBG-FQEVSTJZSA-N -HMDB0011144 424.295376167 LysoPA(18:0e/0:0) C21H45O6P HUUYDUFSUADEJQ-UHFFFAOYSA-N -HMDB0011149 509.384525041 LysoPC(O-18:0) C26H56NO6P XKBJVQHMEXMFDZ-AREMUKBSSA-N -HMDB0011151 743.582890495 PC(O-16:0/18:2(9Z,12Z)) C42H82NO7P IQACMFWAGALEAQ-WESJWMGVSA-N -HMDB0011152 437.290624657 PE(P-16:0e/0:0) C21H44NO6P QYTPGOPLNFESQC-NUTQULCTSA-N -HMDB0011154 394.248425492 LysoPA(P-16:0e/0:0) C19H39O6P LBGSRVIXIVDRQM-OAXWQBPPSA-N -HMDB0011170 260.137221752 gamma-Glutamylisoleucine C11H20N2O5 SNCKGJWJABDZHI-ZKWXMUAHSA-N -HMDB0011171 260.13722176 gamma-Glutamylleucine C11H20N2O5 MYFMARDICOWMQP-YUMQZZPRSA-N -HMDB0011172 246.121571688 gamma-Glutamylvaline C10H18N2O5 AQAKHZVPOOGUCK-XPUUQOCRSA-N -HMDB0011175 228.147392516 Leucylproline C11H20N2O3 VTJUNIYRYIAIHF-UHFFFAOYSA-N -HMDB0011177 262.131742448 Phenylalanylproline C14H18N2O3 WEQJQNWXCSUVMA-RYUDHWBXSA-N -HMDB0011178 172.08479226 Prolylglycine C7H12N2O3 RNKSNIBMTUYWSH-UHFFFAOYSA-N -HMDB0011179 262.131742452 Prolylphenylalanine C14H18N2O3 IWIANZLCJVYEFX-UHFFFAOYSA-N -HMDB0011188 638.5485401 TG(12:0/12:0/12:0) C39H74O6 VMPHSYLJUKZBJJ-UHFFFAOYSA-N -HMDB0011201 837.624755309 PC(20:3(8Z,11Z,14Z)/20:1(11Z)) C48H88NO8P LZXZOHSYOCWXFB-DWTYVZKUSA-N -HMDB0011202 841.656055437 PC(22:1(13Z)/18:1(11Z)) C48H92NO8P VMYYPARBVHMEFG-WQZYGQBESA-N -HMDB0011203 689.535940303 PC(P-16:0/14:0) C38H76NO7P SOUFUEMRDVBNJD-APMJBGCSSA-N -HMDB0011206 717.567240431 PC(P-16:0/16:0) C40H80NO7P PEWXKAOBUSBJLD-MCBGMKGZSA-N -HMDB0011207 715.551590367 PC(P-16:0/16:1(9Z)) C40H78NO7P FZMYLOBGNYZPQO-QLSONYGBSA-N -HMDB0011209 743.582890495 PC(P-16:0/18:1(11Z)) C42H82NO7P MVDFTRYOOPZXII-JEPFLRBFSA-N -HMDB0011210 743.582890495 PC(P-16:0/18:1(9Z)) C42H82NO7P CRBBMHQTIAELIS-KQBBALDBSA-N -HMDB0011211 741.567240431 PC(P-16:0/18:2(9Z,12Z)) C42H80NO7P QLEHHUPUHJPURI-PWYDUFMYSA-N -HMDB0011212 739.551590367 PC(P-16:0/18:3(6Z,9Z,12Z)) C42H78NO7P MNOGOEJZCHBAEJ-LGHFGPIWSA-N -HMDB0011213 739.551590367 PC(P-16:0/18:3(9Z,12Z,15Z)) C42H78NO7P WXQJKOUXCWEMOK-LUPMRSKMSA-N -HMDB0011214 737.535940303 PC(P-16:0/18:4(6Z,9Z,12Z,15Z)) C42H76NO7P DFANIYFZNIJQEP-FAVOOIQCSA-N -HMDB0011215 773.629840687 PC(P-16:0/20:0) C44H88NO7P HGGMAPXNHACWRM-PHHYKNGOSA-N -HMDB0011216 771.614190623 PC(P-16:0/20:1(11Z)) C44H86NO7P WXILBCFZIXHZIG-KOUVQCMKSA-N -HMDB0011217 769.598540559 PC(P-16:0/20:2(11Z,14Z)) C44H84NO7P DORCYMODRHDYER-VTLIZAISSA-N -HMDB0011218 767.582890495 PC(P-16:0/20:3(5Z,8Z,11Z)) C44H82NO7P XWYIIYJIVUGRQE-YDGSBDHOSA-N -HMDB0011219 767.582890495 PC(P-16:0/20:3(8Z,11Z,14Z)) C44H82NO7P SWWXTMWKIUVGCD-NXTBAPBJSA-N -HMDB0011221 765.567240431 PC(P-16:0/20:4(8Z,11Z,14Z,17Z)) C44H80NO7P FYYVVICAMXUASI-YEHIGFSXSA-N -HMDB0011223 801.661140815 PC(P-16:0/22:0) C46H92NO7P RWOMITBJCKQBQB-ZUELBQRLSA-N -HMDB0011224 799.645490751 PC(P-16:0/22:1(13Z)) C46H90NO7P CJDGKVVSPZVIEB-NYALRLSRSA-N -HMDB0011226 793.598540559 PC(P-16:0/22:4(7Z,10Z,13Z,16Z)) C46H84NO7P DQZNSYOOQMCBDC-PZVMGWTJSA-N -HMDB0011227 791.582890495 PC(P-16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C46H82NO7P FAKYQMLQEAQOLK-LHZZQLRFSA-N -HMDB0011229 789.567240431 PC(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H80NO7P QICWUUGBNFIZAZ-VEOGPPBOSA-N -HMDB0011230 829.692440943 PC(P-16:0/24:0) C48H96NO7P GADWRGZCWDFELP-SATDTQGDSA-N -HMDB0011231 827.676790879 PC(P-16:0/24:1(15Z)) C48H94NO7P MFWRQYURIQTOKU-FIXDCBGKSA-N -HMDB0011234 727.587976362 PC(P-16:0/P-18:1(11Z)) C42H82NO6P OKKXTXQOJMLVPP-JLFFLFAUSA-N -HMDB0011235 727.587976362 PC(P-16:0/P-18:1(9Z)) C42H82NO6P XNZRITUHRJESOL-BCZCSWKFSA-N -HMDB0011237 715.551590367 PC(P-18:0/14:1(9Z)) C40H78NO7P YCWPYAHFDSLECT-ZFHQVLSYSA-N -HMDB0011240 743.582890495 PC(P-18:0/16:1(9Z)) C42H82NO7P KMNVIRCHUMQGHD-RCINKDPXSA-N -HMDB0011241 773.629840687 PC(P-18:0/18:0) C44H88NO7P HCBLXOORGBFPGF-PHHYKNGOSA-N -HMDB0011242 771.614190623 PC(P-18:0/18:1(11Z)) C44H86NO7P JDTHSYITWRQVSV-CESBNGMCSA-N -HMDB0011243 771.614190623 PC(P-18:0/18:1(9Z)) C44H86NO7P DSWOVBIRJNAJAF-NVJOKYTBSA-N -HMDB0011244 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WCSDULLQTPYJFU-CSASKLPHSA-N -HMDB0011407 727.551590367 PE(P-18:1(11Z)/18:1(11Z)) C41H78NO7P URRCZPXKAKNTHV-NZWMGPRYSA-N -HMDB0011408 727.551590367 PE(P-18:1(11Z)/18:1(9Z)) C41H78NO7P VXAQICWVKHYAOM-LQNIOAHJSA-N -HMDB0011413 757.598540559 PE(P-18:1(11Z)/20:0) C43H84NO7P QEDROTQEMCQUNE-QSKLCZHJSA-N -HMDB0011414 755.582890495 PE(P-18:1(11Z)/20:1(11Z)) C43H82NO7P VQMPZNPOSKPGTN-CGPNWZOFSA-N -HMDB0011424 777.567240431 PE(P-18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C45H80NO7P DZPHTQGGRSWHLG-USOCFQKQSA-N -HMDB0011439 729.567240431 PE(P-18:1(9Z)/18:0) C41H80NO7P OBAAWAYLQLYWNN-KHFVPPDWSA-N -HMDB0011440 727.551590367 PE(P-18:1(9Z)/18:1(11Z)) C41H78NO7P CCSPRYPUMQZSKU-UJUPZVJJSA-N -HMDB0011441 727.551590367 PE(P-18:1(9Z)/18:1(9Z)) C41H78NO7P CFANDHZPOSNKNO-UDHSZFGOSA-N -HMDB0011446 757.598540559 PE(P-18:1(9Z)/20:0) C43H84NO7P BOIHDLQLPRODPV-PFGXKIITSA-N -HMDB0011447 755.582890495 PE(P-18:1(9Z)/20:1(11Z)) C43H82NO7P CJTMZOOUZQGAPV-WLKREVAWSA-N -HMDB0011457 777.567240431 PE(P-18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C45H80NO7P PQEYJXRJLFZSPT-ZGMVDJDGSA-N -HMDB0011469 74.073164942 2-Butanol C4H10O BTANRVKWQNVYAZ-UHFFFAOYSA-N -HMDB0011473 453.285539279 LysoPE(0:0/16:0) C21H44NO7P CKPBBEOJHAPPBT-HXUWFJFHSA-N -HMDB0011475 479.301189343 LysoPE(0:0/18:1(11Z)) C23H46NO7P CZYOFWNORPEFDG-KOIKXXGWSA-N -HMDB0011476 479.301189343 LysoPE(0:0/18:1(9Z)) C23H46NO7P NOVZJYYJYIFXJC-MZMPXXGTSA-N -HMDB0011478 475.269889215 LysoPE(0:0/18:3(6Z,9Z,12Z)) C23H42NO7P QYXNIRQICOBIAE-CSLWLMPESA-N -HMDB0011483 505.316839407 LysoPE(0:0/20:2(11Z,14Z)) C25H48NO7P NHBRVTKHMMOYTG-XBJNFHHOSA-N -HMDB0011500 425.254239151 LysoPE(14:0/0:0) C19H40NO7P RPXHXZNGZBHSMJ-GOSISDBHSA-N -HMDB0011502 439.269889215 LysoPE(15:0/0:0) C20H42NO7P FGHPDPYCRTXYNZ-LJQANCHMSA-N -HMDB0011503 453.285539279 LysoPE(16:0/0:0) C21H44NO7P YVYMBNSKXOXSKW-HXUWFJFHSA-N -HMDB0011505 479.301189343 LysoPE(18:1(11Z)/0:0) C23H46NO7P WAYKKNOEMJFLDI-KOIKXXGWSA-N -HMDB0011506 479.301189343 LysoPE(18:1(9Z)/0:0) C23H46NO7P PYVRVRFVLRNJLY-MZMPXXGTSA-N -HMDB0011507 477.285539279 LysoPE(18:2(9Z,12Z)/0:0) C23H44NO7P DBHKHNGBVGWQJE-USWSLJGRSA-N -HMDB0011513 505.316839407 LysoPE(20:2(11Z,14Z)/0:0) C25H48NO7P QJHRNPQXCMXOOH-XBJNFHHOSA-N -HMDB0011530 302.245709576 MG(0:0/14:0/0:0) C17H34O4 TVIMZSOUQXNWHO-UHFFFAOYSA-N -HMDB0011531 300.230059512 MG(0:0/14:1(9Z)/0:0) C17H32O4 UETKPVCPWANBPE-WAYWQWQTSA-N -HMDB0011532 316.26135964 MG(0:0/15:0/0:0) C18H36O4 SJUYTIGRIZBTCI-UHFFFAOYSA-N -HMDB0011533 330.277009704 MG(0:0/16:0/0:0) C19H38O4 BBNYCLAREVXOSG-UHFFFAOYSA-N -HMDB0011534 328.26135964 MG(0:0/16:1(9Z)/0:0) C19H36O4 CXUXMSACCLYMBI-FPLPWBNLSA-N -HMDB0011535 358.308309832 MG(0:0/18:0/0:0) C21H42O4 YQEMORVAKMFKLG-UHFFFAOYSA-N -HMDB0011536 356.292659768 MG(0:0/18:1(11Z)/0:0) C21H40O4 OTDARJOVCLILGQ-FPLPWBNLSA-N -HMDB0011537 356.292659768 MG(0:0/18:1(9Z)/0:0) C21H40O4 UPWGQKDVAURUGE-KTKRTIGZSA-N -HMDB0011538 354.277009704 MG(0:0/18:2(9Z,12Z)/0:0) C21H38O4 IEPGNWMPIFDNSD-HZJYTTRNSA-N -HMDB0011539 352.26135964 MG(0:0/18:3(6Z,9Z,12Z)/0:0) C21H36O4 BXAXVVVVPFELOK-QNEBEIHSSA-N -HMDB0011540 352.26135964 MG(0:0/18:3(9Z,12Z,15Z)/0:0) C21H36O4 ZCCLDKGWJIREQF-PDBXOOCHSA-N -HMDB0011541 350.245709576 MG(0:0/18:4(6Z,9Z,12Z,15Z)/0:0) C21H34O4 WNCUAIVHPMNYAK-LTKCOYKYSA-N -HMDB0011542 386.33960996 MG(0:0/20:0/0:0) C23H46O4 KECCPKLXQUOWMI-UHFFFAOYSA-N -HMDB0011543 384.323959896 MG(0:0/20:1(11Z)/0:0) C23H44O4 YRAZXZXQMMJRRV-KTKRTIGZSA-N -HMDB0011544 382.308309832 MG(0:0/20:2(11Z,14Z)/0:0) C23H42O4 PMJSUEZTCFTBMD-HZJYTTRNSA-N -HMDB0011546 380.292659768 MG(0:0/20:3(5Z,8Z,11Z)/0:0) C23H40O4 CRSKSGIHJXUIHD-YOILPLPUSA-N -HMDB0011547 380.292659768 MG(0:0/20:3(8Z,11Z,14Z)/0:0) C23H40O4 FHCHFKIVIFQBSC-QNEBEIHSSA-N -HMDB0011549 378.277009704 MG(0:0/20:4(8Z,11Z,14Z,17Z)/0:0) C23H38O4 JCKNHZDBFKYTQU-LTKCOYKYSA-N -HMDB0011550 376.26135964 MG(0:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C23H36O4 IXSYVBCFIGEECR-JLNKQSITSA-N -HMDB0011551 414.370910088 MG(0:0/22:0/0:0) C25H50O4 DNULQWTYMFQUHB-UHFFFAOYSA-N -HMDB0011552 412.355260024 MG(0:0/22:1(13Z)/0:0) C25H48O4 TZDOBCZHGBGJLS-KTKRTIGZSA-N -HMDB0011553 410.33960996 MG(0:0/22:2(13Z,16Z)/0:0) C25H46O4 PFISEVUKDJTNGO-HZJYTTRNSA-N -HMDB0011554 406.308309832 MG(0:0/22:4(7Z,10Z,13Z,16Z)/0:0) C25H42O4 DVYDCUGIJCYIQN-DOFZRALJSA-N -HMDB0011555 404.292659768 MG(0:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0) C25H40O4 NPZWSBAEZZLYQU-WMPRHZDHSA-N -HMDB0011556 404.292659768 MG(0:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0) C25H40O4 LRBJILYYDLUADN-JLNKQSITSA-N -HMDB0011557 402.277009704 MG(0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) C25H38O4 NHNGEAQTTQPSCX-KUBAVDMBSA-N -HMDB0011558 442.402210216 MG(0:0/24:0/0:0) C27H54O4 SNMGFBFZTAYEBF-UHFFFAOYSA-N -HMDB0011559 440.386560152 MG(0:0/24:1(15Z)/0:0) C27H52O4 HXZFYDGMORCWCA-KTKRTIGZSA-N -HMDB0011561 302.245709576 MG(14:0/0:0/0:0) C17H34O4 DCBSHORRWZKAKO-INIZCTEOSA-N -HMDB0011562 300.230059512 MG(14:1(9Z)/0:0/0:0) C17H32O4 ARCRKLOZHGPFFJ-KJPDOMRESA-N -HMDB0011563 316.26135964 MG(15:0/0:0/0:0) C18H36O4 QSKPZDMBULYMDQ-KRWDZBQOSA-N -HMDB0011564 330.277009704 MG(16:0/0:0/0:0) C19H38O4 QHZLMUACJMDIAE-SFHVURJKSA-N -HMDB0011565 328.26135964 MG(16:1(9Z)/0:0/0:0) C19H36O4 KVYUBFKSKZWZSV-ZEVQVBBLSA-N -HMDB0011566 356.292659768 MG(18:1(11Z)/0:0/0:0) C21H40O4 KJHYUSLWTPMFTN-AQWUKCDYSA-N -HMDB0011567 356.292659768 MG(18:1(9Z)/0:0/0:0) C21H40O4 RZRNAYUHWVFMIP-QJRAZLAKSA-N -HMDB0011568 354.277009704 MG(18:2(9Z,12Z)/0:0/0:0) C21H38O4 WECGLUPZRHILCT-GSNKCQISSA-N -HMDB0011569 352.26135964 MG(18:3(6Z,9Z,12Z)/0:0/0:0) C21H36O4 XQBHBEXBUZDCRY-FFXVNFNPSA-N -HMDB0011570 352.26135964 MG(18:3(9Z,12Z,15Z)/0:0/0:0) C21H36O4 GGJRAQULURVTAJ-IWFQAGGASA-N -HMDB0011571 350.245709576 MG(18:4(6Z,9Z,12Z,15Z)/0:0/0:0) C21H34O4 YICVZGXPPMTJCG-LIYQNMAISA-N -HMDB0011572 386.33960996 MG(20:0/0:0/0:0) C23H46O4 UMEKPPOFCOUEDT-QFIPXVFZSA-N -HMDB0011573 384.323959896 MG(20:1(11Z)/0:0/0:0) C23H44O4 HPTOSMWVVSKAGZ-DYYZXQNHSA-N -HMDB0011574 382.308309832 MG(20:2(11Z,14Z)/0:0/0:0) C23H42O4 QRBGFYBOCBYOSN-KDTZXJSHSA-N -HMDB0011576 380.292659768 MG(20:3(5Z,8Z,11Z)/0:0/0:0) C23H40O4 NXOGCYSVLAIYAP-UXNAVHBBSA-N -HMDB0011577 380.292659768 MG(20:3(8Z,11Z,14Z)/0:0/0:0) C23H40O4 LERKRWCYZNDWFH-YYRPCZOWSA-N -HMDB0011578 378.277009704 MG(20:4(5Z,8Z,11Z,14Z)/0:0/0:0) C23H38O4 DCPCOKIYJYGMDN-HUDVFFLJSA-N -HMDB0011579 378.277009704 MG(20:4(8Z,11Z,14Z,17Z)/0:0/0:0) C23H38O4 LWXLRBPWKGXXED-FZLOBDGKSA-N -HMDB0011580 376.26135964 MG(20:5(5Z,8Z,11Z,14Z,17Z)/0:0/0:0) C23H36O4 DFRRSBYSSXKROX-GABUGCEHSA-N -HMDB0011581 414.370910088 MG(22:0/0:0/0:0) C25H50O4 OKMWKBLSFKFYGZ-DEOSSOPVSA-N -HMDB0011582 412.355260024 MG(22:1(13Z)/0:0/0:0) C25H48O4 ZXNAIPHYBVMMPY-DHSLYTQISA-N -HMDB0011583 410.33960996 MG(22:2(13Z,16Z)/0:0/0:0) C25H46O4 UCYPOAPUDLUXQX-VXOKBQSKSA-N -HMDB0011584 406.308309832 MG(22:4(7Z,10Z,13Z,16Z)/0:0/0:0) C25H42O4 UDZUDFKFJCAENZ-UGLSNKNVSA-N -HMDB0011585 404.292659768 MG(22:5(4Z,7Z,10Z,13Z,16Z)/0:0/0:0) C25H40O4 HDIQCISTZKHUDO-AJWITYRPSA-N -HMDB0011586 404.292659768 MG(22:5(7Z,10Z,13Z,16Z,19Z)/0:0/0:0) C25H40O4 IDSLCYURGAOTOA-YAWQMZOFSA-N -HMDB0011587 402.277009704 MG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0/0:0) C25H38O4 JWPHORDRFVRZPP-PJEZTNATSA-N -HMDB0011588 442.402210216 MG(24:0/0:0/0:0) C27H54O4 KIWLCEXSSGNBJU-SANMLTNESA-N -HMDB0011589 440.386560152 MG(24:1(15Z)/0:0/0:0) C27H52O4 NVQGQHXFWUBOAU-IMHHWWNFSA-N -HMDB0011593 917.680342131 "Lactosylcermide (d18:1/20:0)" C50H95NO13 FGJIXPPBZNPEHW-CRMMDXJYSA-N -HMDB0011594 945.711642259 "Lactosylceramide (d18:1/22:0)" C52H99NO13 QYWVASPEUXEHSY-NNRNTGNWSA-N -HMDB0011616 329.052519653 "Adenosine 2',3'-cyclic phosphate" C10H12N5O6P KMYWVDDIPVNLME-UHFFFAOYSA-N -HMDB0011623 156.151415262 Decanal C10H20O KSMVZQYAVGTKIV-UHFFFAOYSA-N -HMDB0011624 158.167065326 "Decyl alcohol " C10H22O MWKFXSUHUHTGQN-UHFFFAOYSA-N -HMDB0011626 186.198365454 Dodecanol C12H26O LQZZUXJYWNFBMV-UHFFFAOYSA-N -HMDB0011632 182.07903818 L-Iditol C6H14O6 FBPFZTCFMRRESA-UNTFVMJOSA-N -HMDB0011635 188.014329434 "p-Cresol sulfate" C7H8O4S WGNAKZGUSRVWRH-UHFFFAOYSA-N -HMDB0011638 214.229665582 Tetradecanol C14H30O HLZKNKRTKFSKGZ-UHFFFAOYSA-N -HMDB0011640 306.02530185 "Uridine 2',3'-cyclic phosphate " C9H11N2O8P HWDMHJDYMFRXOX-XVFCMESISA-N -HMDB0011667 204.074621504 gamma-Glutamylglycine C7H12N2O5 ACIJGUBIMXQCMF-BYPYZUCNSA-N -HMDB0011698 843.731900454 SM(d18:1/26:0) C49H100N2O6P VRAWSAPVSSLIRI-MVUJCARGSA-O -HMDB0011701 842.736340876 TG(15:0/16:0/20:3(8Z,11Z,14Z)) C54H98O6 NVBSJAZGISYRIW-GGVKXYRHSA-N -HMDB0011704 842.736340876 TG(15:0/18:0/18:3(9Z,12Z,15Z)) C54H98O6 QELMLHKKGIZABI-DSCMALIJSA-N -HMDB0011708 842.736340876 TG(15:0/18:1(9Z)/18:2(9Z,12Z)) C54H98O6 AFUGNQFGFOCTMS-RVTXQWIBSA-N -HMDB0011718 122.036779436 4-Hydroxybenzaldehyde C7H6O2 RGHHSNMVTDWUBI-UHFFFAOYSA-N -HMDB0011724 124.0524295 "4-Hydroxybenzyl alcohol" C7H8O2 BVJSUAQZOZWCKN-UHFFFAOYSA-N -HMDB0011731 194.042652674 5-Keto-D-gluconate C6H10O7 IZSRJDGCGRAUAR-UHFFFAOYSA-N -HMDB0011732 194.042652674 2-Keto-L-gluconate C6H10O7 VBUYCZFBVCCYFD-UHFFFAOYSA-N -HMDB0011733 132.053492132 Glycyl-glycine C4H8N2O3 YMAWOPBAYDPSLA-UHFFFAOYSA-N -HMDB0011737 276.095750876 "gamma-Glutamylglutamic acid" C10H16N2O7 OWQDWQKWSLFFFR-WDSKDSINSA-N -HMDB0011738 275.111735291 N2-gamma-Glutamylglutamine C10H17N3O6 JBFYFLXEJFQWMU-WDSKDSINSA-N -HMDB0011741 310.116486318 gamma-Glutamyltyrosine C14H18N2O6 VVLXCWVSSLFQDS-QWRGUYRKSA-N -HMDB0011745 191.061613977 N-Acetyl-L-methionine C7H13NO3S XUYPXLNMDZIRQH-UHFFFAOYSA-N -HMDB0011747 125.024179639 Ciliatine C2H8NO3P QQVDJLLNRSOCEL-UHFFFAOYSA-N -HMDB0011749 99.068413915 2-Piperidinone C5H9NO XUWHAWMETYGRKB-UHFFFAOYSA-N -HMDB0011756 173.105193351 N-Acetylleucine C8H15NO3 WXNXCEHXYPACJF-ZETCQYMHSA-N -HMDB0011757 159.089543287 N-Acetylvaline C7H13NO3 IHYJTAOFMMMOPX-UHFFFAOYSA-N -HMDB0011760 539.527745079 Cer(d18:0/16:0) C34H69NO3 GCGTXOVNNFGTPQ-JHOUSYSJSA-N -HMDB0011761 567.559045207 Cer(d18:0/18:0) C36H73NO3 KZTJQXAANJHSCE-OIDHKYIRSA-N -HMDB0011764 595.590345335 Cer(d18:0/20:0) C38H77NO3 ZWAUSWHRQBSECP-PQQNNWGCSA-N -HMDB0011765 623.621645463 Cer(d18:0/22:0) C40H81NO3 SXPRAKSDHOEHIG-ZESVVUHVSA-N -HMDB0011767 637.637295527 Cer(d18:0/23:0) C41H83NO3 FTSDYFFYZJTACJ-IOLBBIBUSA-N -HMDB0011768 651.652945591 Cer(d18:0/24:0) C42H85NO3 BPLYVSYSBPLDOA-WVILEFPPSA-N -HMDB0011770 665.668595655 Cer(d18:0/25:0) C43H87NO3 HCDLRJUFVJOBJP-ACEXITHZSA-N -HMDB0011771 679.684245719 Cer(d18:0/26:0) C44H89NO3 NWERZHCPHDHUMO-WZYYJWNZSA-N -HMDB0012085 676.551924718 SM(d18:0/14:0) C37H77N2O6P MJAFYELZQYPMQG-MPQUPPDSSA-N -HMDB0012087 732.614524974 SM(d18:0/18:0) C41H85N2O6P JCELSEVNSMXGKA-IOLBBIBUSA-N -HMDB0012088 730.59887491 SM(d18:0/18:1(11Z)) C41H83N2O6P HHAUPBIWIXBMEU-MMVRYLQTSA-N -HMDB0012089 730.59887491 SM(d18:0/18:1(9Z)) C41H83N2O6P XYLWKHKCYHMVMA-RVPJYPCXSA-N -HMDB0012090 760.645825102 SM(d18:0/20:0) C43H89N2O6P UGRZESKDAPEULH-ACEXITHZSA-N -HMDB0012091 788.67712523 SM(d18:0/22:0) C45H93N2O6P FONAXCRWZQFJHY-JCGOJSMZSA-N -HMDB0012094 816.708425358 SM(d18:0/24:0) C47H97N2O6P SMJLGESYPKPRNU-CRCOQUFZSA-N -HMDB0012097 674.536274654 SM(d18:1/14:0) C37H75N2O6P KYICBZWZQPCUMO-PSALXKTOSA-N -HMDB0012101 728.583224846 SM(d18:1/18:1(9Z)) C41H81N2O6P NBEADXWAAWCCDG-QDDWGVBQSA-N -HMDB0012102 758.630175038 SM(d18:1/20:0) C43H87N2O6P AADLTHQNYQJHQV-SVLGDMRNSA-N -HMDB0012103 786.661475166 SM(d18:1/22:0) C45H91N2O6P FJJANLYCZUNFSE-TWKUQIQBSA-N -HMDB0012105 800.67712523 SM(d18:1/23:0) C46H93N2O6P SXZWBNWTCVLZJN-NMIJJABPSA-N -HMDB0012107 812.67712523 SM(d18:1/24:1(15Z)) C47H93N2O6P WKZHECFHXLTOLJ-QYKFWSDSSA-N -HMDB0012108 509.348139535 LysoPC(17:0) C25H52NO7P SRRQPVVYXBTRQK-XMMPIXPASA-N -HMDB0012141 134.057908808 (R)-2,3-Dihydroxy-isovalerate C5H10O4 JTEYKUFKXGDTEU-VKHMYHEASA-N -HMDB0012154 159.089543287 3-Dehydrocarnitine C7H13NO3 YNOWULSFLVIUDH-UHFFFAOYSA-N -HMDB0012157 84.057514878 3-Methyl-2-butenal C5H8O SEPQTYODOKLVSB-UHFFFAOYSA-N -HMDB0012166 430.344695338 4alpha-Carboxy-5alpha-cholesta-8-en-3beta-ol C28H46O3 RODBXVVNKJCWQR-KLZNZPMLSA-N -HMDB0012225 164.047344122 Enol-phenylpyruvate C9H8O3 DEDGUGJNLNLJSR-VURMDHGXSA-N -HMDB0012252 323.282429433 "Linoleoyl ethanolamide" C20H37NO2 KQXDGUVSAAQARU-HZJYTTRNSA-N -HMDB0012273 255.256214683 "Palmitic amide" C16H33NO HSEMFIZWXHQJAE-UHFFFAOYSA-N -HMDB0012275 121.089149357 Phenylethylamine C8H11N BHHGXPLMPWCGHP-UHFFFAOYSA-N -HMDB0012308 152.047344122 Vanillin C8H8O3 MWOOGOJBHIARFG-UHFFFAOYSA-N -HMDB0012328 254.224580204 "Palmitelaidic acid" C16H30O2 SECPZKHBENQXJG-BQYQJAHWSA-N -HMDB0012336 731.473733977 PS(14:0/18:2(9Z,12Z)) C38H70NO10P QPLGPOYWQGNODB-OPLANILISA-N -HMDB0012338 757.489384041 PS(14:0/20:3(8Z,11Z,14Z)) C40H72NO10P FGWZGYGIIUCSFO-HNOMVOJUSA-N -HMDB0012346 731.473733977 PS(14:1(9Z)/18:1(9Z)) C38H70NO10P QBNCFMDNNPQYIL-NTEBNZJHSA-N -HMDB0012359 757.489384041 PS(16:0/18:3(9Z,12Z,15Z)) C40H72NO10P GRXQVLCZJYBDDD-HPYWTVDESA-N -HMDB0012360 785.520684169 PS(16:0/20:3(8Z,11Z,14Z)) C42H76NO10P AURXVWGKRCWXBT-BDVHGAHCSA-N -HMDB0012361 783.505034105 PS(16:0/20:4(5Z,8Z,11Z,14Z)) C42H74NO10P DKLQKRSJZISZKW-KNFJROLASA-N -HMDB0012366 731.473734456 PS(16:1(9Z)/16:1(9Z)) C38H70NO10P SYAYTZJXUCQTMJ-XOZMKWGESA-N -HMDB0012369 757.489384041 PS(16:1(9Z)/18:2(9Z,12Z)) C40H72NO10P DWNFLQISNVMTDP-FIAXNTQPSA-N -HMDB0012371 783.505034105 PS(16:1(9Z)/20:3(8Z,11Z,14Z)) C42H74NO10P KDQCUZMSFTUKER-DTHZZQGCSA-N -HMDB0012381 785.520684169 PS(18:0/18:3(9Z,12Z,15Z)) C42H76NO10P FJJVJFAWOZTCBP-XCOFVSEPSA-N -HMDB0012383 811.536334233 PS(18:0/20:4(5Z,8Z,11Z,14Z)) C44H78NO10P SVOUGFFDROZBJI-DNALCEECSA-N -HMDB0012386 731.473733977 PS(18:1(9Z)/14:1(9Z)) C38H70NO10P GKXJCTQSLVKTAV-NTEBNZJHSA-N -HMDB0012391 785.520684169 PS(18:1(9Z)/18:2(9Z,12Z)) C42H76NO10P MWONMGIZXLAUBR-QUBHBNJHSA-N -HMDB0012392 783.505034105 PS(18:1(9Z)/18:3(9Z,12Z,15Z)) C42H74NO10P MUEUZLYKGCAEFG-ZENWUCLUSA-N -HMDB0012396 731.473733977 PS(18:2(9Z,12Z)/14:0) C38H70NO10P LZBAIACFBSMXFQ-OPLANILISA-N -HMDB0012399 757.489384041 PS(18:2(9Z,12Z)/16:1(9Z)) C40H72NO10P QFGBUBRLCJWGHL-FIAXNTQPSA-N -HMDB0012401 785.520684169 PS(18:2(9Z,12Z)/18:1(9Z)) C42H76NO10P HCMPQQOKSNDTHI-UTJDFHGQSA-N -HMDB0012402 783.505034105 PS(18:2(9Z,12Z)/18:2(9Z,12Z)) C42H74NO10P ZTNFQEXYTMNFHG-SOFXVBFTSA-N -HMDB0012409 757.489384041 PS(18:3(9Z,12Z,15Z)/16:0) C40H72NO10P MGXXGWZPTJJSOQ-HPYWTVDESA-N -HMDB0012411 785.520684169 PS(18:3(9Z,12Z,15Z)/18:0) C42H76NO10P DBFYXFUOCIHCAH-YHTHSIKYSA-N -HMDB0012412 783.505034105 PS(18:3(9Z,12Z,15Z)/18:1(9Z)) C42H74NO10P FCMMQVCGAUYOQK-SRXFDEGJSA-N -HMDB0012418 757.489384041 PS(20:3(8Z,11Z,14Z)/14:0) C40H72NO10P RGLIERIRKNERBJ-HNOMVOJUSA-N -HMDB0012420 785.520684169 PS(20:3(8Z,11Z,14Z)/16:0) C42H76NO10P KEDXPDZZNJECIF-BDVHGAHCSA-N -HMDB0012421 783.505034105 PS(20:3(8Z,11Z,14Z)/16:1(9Z)) C42H74NO10P JOPLYMFHYSLQEE-DTHZZQGCSA-N -HMDB0012431 783.505034105 PS(20:4(5Z,8Z,11Z,14Z)/16:0) C42H74NO10P YGVOIKRHQZUTHL-UTORSVHMSA-N -HMDB0012504 338.245709576 "10,11-dihydro-leukotriene B4" C20H34O4 NKUPFHTVILUPKF-RNEQFKNCSA-N -HMDB0012798 320.198759384 5'-Carboxy-alpha-chromanol C19H28O4 QWPNLVBAEZJBMI-IMFVZPHKSA-N -HMDB0012819 224.079706882 5-Hydroxykynurenine C10H12N2O4 OTDQYOVYQQZAJL-UHFFFAOYSA-N -HMDB0012897 168.068748266 Beta-Carboline C11H8N2 AIFRHYZBTHREPW-UHFFFAOYSA-N -HMDB0012971 102.10446507 1-Hexanol C6H14O ZSIAUFGUXNUGDI-UHFFFAOYSA-N -HMDB0013034 313.261693991 Palmitoylglycine C18H35NO3 KVTFEOAKFFQCCX-UHFFFAOYSA-N -HMDB0013036 88.088815006 1-Pentanol C5H12O AMQJEAYHLZJPGS-UHFFFAOYSA-N -HMDB0013078 327.313729561 Stearoylethanolamide C20H41NO2 OTGQIQQTPXJQRG-UHFFFAOYSA-N -HMDB0013124 215.115758037 Propenoylcarnitine C10H17NO4 YUCNWOKTRWJLGY-QMMMGPOBSA-N -HMDB0013125 233.126322723 Hydroxypropionylcarnitine C10H19NO5 QJGJXKFJFRSERW-QMMMGPOBSA-N -HMDB0013126 229.131408101 Butenylcarnitine C11H19NO4 HQDBMDGXEZLSNK-CYNONHLPSA-N -HMDB0013127 247.141972787 Hydroxybutyrylcarnitine C11H21NO5 UEFRDQSMQXDWTO-GKAPJAKFSA-N -HMDB0013128 246.169984677 Valerylcarnitine C12H24NO4 VSNFQQXVMPSASB-SNVBAGLBSA-O -HMDB0013129 273.121237345 Glutaconylcarnitine C12H19NO6 JXVUHLILXGZLFR-DNQSNQRASA-N -HMDB0013130 275.1368874 Glutarylcarnitine C12H21NO6 NXJAXUYOQLTISD-SECBINFHSA-N -HMDB0013132 263.173272915 Hydroxyvalerylcarnitine C12H25NO5 PSRQDLCMEPQOQH-YZRBJQDESA-N -HMDB0013161 257.162708229 2-Hexenoylcarnitine C13H23NO4 JUAQYRSUSCWTQK-BQYQJAHWSA-N -HMDB0013198 184.037173366 "4-O-Methylgallic acid" C8H8O5 UBXDWYFLYYJQFR-UHFFFAOYSA-N -HMDB0013205 313.225308485 9-Decenoylcarnitine C17H31NO4 GOOOCIIXFLVRAG-UHFFFAOYSA-N -HMDB0013207 397.319208869 9-Hexadecenoylcarnitine C23H43NO4 ZVOMLLYYTWFWOA-XPTLAUCJSA-N -HMDB0013209 275.126991425 Alanyltryptophan C14H17N3O3 CBUUWFVFZSZOAK-UFBFGSQYSA-N -HMDB0013231 45.057849229 Ethylamine C2H7N QUSNBJAOOMFDIB-UHFFFAOYSA-N -HMDB0013240 303.121906047 "Indoleacetyl glutamine" C15H17N3O4 DVJIJAYHBZALOJ-UHFFFAOYSA-N -HMDB0013243 278.16304258 Leucyl-phenylalanine C15H22N2O3 KFKWRHQBZQICHA-UHFFFAOYSA-N -HMDB0013253 153.090211989 "N-Acetylhistamine " C7H11N3O XJWPISBUKWZALE-UHFFFAOYSA-N -HMDB0013288 301.225308485 Nonanoylcarnitine C16H31NO4 MPSPNFAQQQMFLK-UHFFFAOYSA-N -HMDB0013299 228.245315646 Pentadecanol C15H32O REIUXOLGHVXAEO-UHFFFAOYSA-N -HMDB0013302 312.147392516 Phenylalanylphenylalanine C18H20N2O3 GKZIWHRNKRBEOH-UHFFFAOYSA-N -HMDB0013316 200.214015518 Tridecanol C13H28O XFRVVPUIAFSTFO-UHFFFAOYSA-N -HMDB0013326 341.256608613 trans-2-Dodecenoylcarnitine C19H35NO4 JEOZLTJHDSKQIT-KRWDZBQOSA-N -HMDB0013327 373.246437857 Dodecanedioylcarnitine C19H35NO6 VJPIDPQNAYWULC-INIZCTEOSA-N -HMDB0013328 303.168187537 Pimelylcarnitine C14H25NO6 AUWRHMAICBSXMC-NSHDSACASA-N -HMDB0013329 369.287908741 trans-2-Tetradecenoylcarnitine C21H39NO4 VDPVQRIJJXMKLV-VVLLFNJHSA-N -HMDB0013330 385.282823363 3-Hydroxy-cis-5-tetradecenoylcarnitine C21H39NO5 BCZXLGKYFZTAJX-JDWANTKOSA-N -HMDB0013333 413.314123491 3-Hydroxy-9-hexadecenoylcarnitine C23H43NO5 WAGYLURELCUJPG-RPZXQYRRSA-N -HMDB0013334 395.303558805 9,12-Hexadecadienoylcarnitine C23H41NO4 AHZCIODFJPNPKS-XBDLETADSA-N -HMDB0013336 415.329773555 3-Hydroxyhexadecanoylcarnitine C23H45NO5 MHJOYNGEDDXLLU-LBAQZLPGSA-N -HMDB0013337 415.329773555 2-Hydroxyhexadecanoylcarnitine C23H45NO5 ALAYOLIEZSXQPY-LBAQZLPGSA-N -HMDB0013339 441.345423619 3-Hydroxy-11Z-octadecenoylcarnitine C25H47NO5 DGNPJQDFCXFOEZ-OEPBMOORSA-N -HMDB0013340 441.345423619 3-Hydroxy-9Z-octadecenoylcarnitine C25H47NO5 ARMIMRSBKXMKOF-QXZRMERTSA-N -HMDB0013341 691.551590367 PC(o-14:0/16:0) C38H78NO7P BYMZZQJJOHDZOU-DIPNUNPCSA-N -HMDB0013402 689.535940303 PC(o-14:0/16:1(9Z)) C38H76NO7P ZCNUNZUDXNSNRZ-WTWBAFHPSA-N -HMDB0013403 689.535940303 PC(o-16:0/14:1(9Z)) C38H76NO7P YMBXMIQDISYIFB-IEHWZJNJSA-N -HMDB0013404 717.567240431 PC(o-16:0/16:1(9Z)) C40H80NO7P HJVQHTGUAIETCQ-VEAYGOGPSA-N -HMDB0013405 747.614190623 PC(o-16:0/18:0) C42H86NO7P PXPSGTINXJQLBR-VQJSHJPSSA-N -HMDB0013406 775.645490751 PC(o-16:0/20:0) C44H90NO7P QFZSBLJYDQLBAG-VZUYHUTRSA-N -HMDB0013407 767.582890495 PC(o-16:0/20:4(8Z,11Z,14Z,17Z)) C44H82NO7P SOUZQPFUXRVDGK-KCTKZSJBSA-N -HMDB0013408 803.676790879 PC(o-16:0/22:0) C46H94NO7P BIIIEBBIUJYGBZ-WBVITSLISA-N -HMDB0013409 791.582890495 PC(o-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C46H82NO7P QQQQNYAHSSIZBU-HIQXTUQZSA-N -HMDB0013410 687.520290239 PC(o-16:1(9Z)/14:1(9Z)) C38H74NO7P SPPSEAUTRSATJZ-LSVLUJLYSA-N -HMDB0013411 715.551590367 PC(o-16:1(9Z)/16:1(9Z)) C40H78NO7P MZDGVRYVGYDNAO-KETLZHFASA-N -HMDB0013412 745.598540559 PC(o-16:1(9Z)/18:0) C42H84NO7P SVSLBZPEDBYFGG-HVLKLTLRSA-N -HMDB0013413 741.567240431 PC(o-16:1(9Z)/18:2(9Z,12Z)) C42H80NO7P AXCLECQLCBWNLZ-KZZBVOOISA-N -HMDB0013414 773.629840687 PC(o-16:1(9Z)/20:0) C44H88NO7P NEMVGIRAGVGOLH-RPBJOJELSA-N -HMDB0013415 765.567240431 PC(o-16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C44H80NO7P HOTMLHWJOWGLLX-UZKIFIPLSA-N -HMDB0013416 801.661140815 PC(o-16:1(9Z)/22:0) C46H92NO7P BEBNKXDYOOYGGD-XMGJQEBSSA-N -HMDB0013417 775.645490751 PC(o-18:0/18:0) C44H90NO7P BKEDGKIMIUGHDV-VZUYHUTRSA-N -HMDB0013418 771.614190623 PC(o-18:0/18:2(9Z,12Z)) C44H86NO7P LMGTVCKIUNTOEP-HJTCUGKVSA-N -HMDB0013419 803.676790879 PC(o-18:0/20:0) C46H94NO7P BVCZSMAYNCVQDT-WBVITSLISA-N -HMDB0013420 795.614190623 PC(o-18:0/20:4(8Z,11Z,14Z,17Z)) C46H86NO7P GBNPCIWXLWZJGA-IGBSIYCFSA-N -HMDB0013421 831.708091007 PC(o-18:0/22:0) C48H98NO7P UWZMUJQZEJOLID-QZNUWAOFSA-N -HMDB0013422 819.614190623 PC(o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C48H86NO7P QBZALASVZLFAHF-KYPHJRDXSA-N -HMDB0013423 859.739391135 PC(o-18:0/24:0) C50H102NO7P ZJMRQFZKFMJBAX-ANFMRNGASA-N -HMDB0013424 745.598540559 PC(o-18:1(11Z)/16:0) C42H84NO7P QCGUXAIDEOWPBV-SNKLRXETSA-N -HMDB0013425 769.598540559 PC(o-18:1(11Z)/18:2(9Z,12Z)) C44H84NO7P KBRIWDRDGVERBB-VXKJXORPSA-N -HMDB0013426 745.598540559 PC(o-18:1(9Z)/16:0) C42H84NO7P IQLHTKSHLGLPMG-HFWGUVFESA-N -HMDB0013427 773.629840687 PC(o-18:1(9Z)/18:0) C44H88NO7P KKPRQPUSFKIYMO-GRVDSVFJSA-N -HMDB0013428 771.614190623 PC(o-18:1(9Z)/18:1(11Z)) C44H86NO7P GSROTDACALJGFK-YIFANWOHSA-N -HMDB0013429 769.598540559 PC(o-18:1(9Z)/18:2(9Z,12Z)) C44H84NO7P MFZLAZYUXHHSIA-HVODBARTSA-N -HMDB0013430 801.661140815 PC(o-18:1(9Z)/20:0) C46H92NO7P XKGBWHAITCMFLI-MWGCQCNTSA-N -HMDB0013431 799.645490751 PC(o-18:1(9Z)/20:1(11Z)) C46H90NO7P OALUPVKKQYLXOY-OGPXCXTMSA-N -HMDB0013432 793.598540559 PC(o-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C46H84NO7P VJNPDLZENXBRLB-MQEDXBOASA-N -HMDB0013433 829.692440943 PC(o-18:1(9Z)/22:0) C48H96NO7P VTSFZGCXFALJSV-FYAZAUILSA-N -HMDB0013434 857.723741071 PC(o-18:1(9Z)/24:0) C50H100NO7P BSQIZOZBOXYNEW-WIEGMJJDSA-N -HMDB0013435 767.582890495 PC(o-18:2(9Z,12Z)/18:2(9Z,12Z)) C44H82NO7P XCCONPVPHCCYNF-KPFPPAHTSA-N -HMDB0013436 799.645490751 PC(o-18:2(9Z,12Z)/20:0) C46H90NO7P MOCFTDNEKLRJLC-HRGHQQQCSA-N -HMDB0013437 827.676790879 PC(o-18:2(9Z,12Z)/22:0) C48H94NO7P DMPIMBNFIDOLGO-DTRJYZOJSA-N -HMDB0013438 855.708091007 PC(o-18:2(9Z,12Z)/24:0) C50H98NO7P SJLRNWKFILQPDM-AARZFCJCSA-N -HMDB0013439 797.629840687 PC(o-20:0/18:3(6Z,9Z,12Z)) C46H88NO7P XHKFHCCQLHPBPZ-WKDUQDSSSA-N -HMDB0013440 797.629840687 PC(o-20:0/18:3(9Z,12Z,15Z)) C46H88NO7P APWUUZRAVVATRC-GBRUYZQDSA-N -HMDB0013441 831.708091007 PC(o-20:0/20:0) C48H98NO7P OZQMKPUQMDJPII-QZNUWAOFSA-N -HMDB0013442 823.645490751 PC(o-20:0/20:4(8Z,11Z,14Z,17Z)) C48H90NO7P RDNHPNJCALITSY-MBZSPAKGSA-N -HMDB0013443 859.739391135 PC(o-20:0/22:0) C50H102NO7P BJUWREINODTBMO-ANFMRNGASA-N -HMDB0013444 821.629840687 PC(o-20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C48H88NO7P UNAQSIZPRIMCTB-QXUJVPJQSA-N -HMDB0013445 825.661140815 PC(o-22:0/18:3(6Z,9Z,12Z)) C48H92NO7P WEFAHDSLMVUAHQ-GEVWEYGMSA-N -HMDB0013446 825.661140815 PC(o-22:0/18:3(9Z,12Z,15Z)) C48H92NO7P CPEAXNSICHTTDR-BKMBJBKQSA-N -HMDB0013447 857.723741071 PC(o-22:0/20:1(11Z)) C50H100NO7P XKPLZICHJPNOFR-WIEGMJJDSA-N -HMDB0013449 881.723741071 PC(o-22:0/22:3(10Z,13Z,16Z)) C52H100NO7P CQBVYLALIKLMGX-TYGMOWAISA-N -HMDB0013450 875.676790879 PC(o-22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C52H94NO7P YLLDQHGIGWZVQP-ITBHSSNISA-N -HMDB0013451 849.661140815 PC(o-22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C50H92NO7P OQRGDDBNUMCNLP-ABEXPZPBSA-N -HMDB0013452 881.723741071 PC(o-22:1(13Z)/22:2(13Z,16Z)) C52H100NO7P VCODWVLGDPOACA-DRGSQYEJSA-N -HMDB0013453 879.708091007 PC(o-22:1(13Z)/22:3(10Z,13Z,16Z)) C52H98NO7P ADCPDRAGQLKVRI-DFPONBFASA-N -HMDB0013455 879.708091007 PC(o-22:2(13Z,16Z)/22:2(13Z,16Z)) C52H98NO7P GCAMFMBVIXVYSA-VIVKCUGUSA-N -HMDB0013456 877.692440943 PC(o-22:2(13Z,16Z)/22:3(10Z,13Z,16Z)) C52H96NO7P CEZAZXUWDFPTTE-FHIJIHMSSA-N -HMDB0013457 875.676790879 PC(o-22:3(10Z,13Z,16Z)/22:3(10Z,13Z,16Z)) C52H94NO7P QZMFOSCFDWPISC-KQHSIIGPSA-N -HMDB0013458 853.692440943 PC(o-24:0/18:3(6Z,9Z,12Z)) C50H96NO7P LDFITNYTODJQBW-AQBSXLNYSA-N -HMDB0013459 853.692440943 PC(o-24:0/18:3(9Z,12Z,15Z)) C50H96NO7P NIIFWBWRLRQUHB-LSTCNRAPSA-N -HMDB0013460 879.708091007 PC(o-24:0/20:4(8Z,11Z,14Z,17Z)) C52H98NO7P AQJDGYZOTXPNFY-ZFRXABNDSA-N -HMDB0013461 840.708425358 SM(d18:1/26:1(17Z)) C49H97N2O6P YXEXWUZHFGYOHJ-UOJCCMJYSA-N -HMDB0013463 716.54683934 SM(d18:0/16:1(9Z)(OH)) C39H77N2O7P LPHMSPONPQCKTL-FKUNDBCPSA-N -HMDB0013464 702.567574782 SM(d18:0/16:1(9Z)) C39H79N2O6P CGVOQSQIYSUXAT-PPLFXBRHSA-N -HMDB0013465 754.59887491 SM(d18:0/20:2(11Z,14Z)) C43H83N2O6P YVTVVJRJLRHYSJ-XJRFMCMQSA-N -HMDB0013467 798.62508966 SM(d18:0/22:2(13Z,16Z)(OH)) C45H87N2O7P DRKCMBAZIYFIGX-ZWLRGCNFSA-N -HMDB0013468 780.614524974 SM(d18:0/22:3(10Z,13Z,16Z)) C45H85N2O6P YTQGMICAWXIKQI-OIMFMVRSSA-N -HMDB0013497 848.460465478 PGP(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C42H74O13P2 NTQLGVPKRSFHIQ-JHDARNQCSA-N -HMDB0013553 848.460465478 PGP(18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) C42H74O13P2 UZDPEBGNSKBQGX-MIIJJXBYSA-N -HMDB0013554 848.460465478 PGP(18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C42H74O13P2 OKSGKZRUQJEAKX-LUEXABFISA-N -HMDB0013567 848.460465478 PGP(18:3(6Z,9Z,12Z)/18:2(9Z,12Z)) C42H74O13P2 OYWQLEFQIHHFDV-YTOJJJGQSA-N -HMDB0013582 848.460465478 PGP(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)) C42H74O13P2 YGJPTGGFWWXCQF-MLMWWJLQSA-N -HMDB0013609 204.089877638 D-Tryptophan C11H12N2O2 QIVBCDIJIAJPQS-SECBINFHSA-N -HMDB0013622 296.271530396 "10Z-Nonadecenoic acid" C19H36O2 BBOWBNGUEWHNQZ-KTKRTIGZSA-N -HMDB0013627 372.266445018 "Cervonoyl ethanolamide" C24H36O3 CXWASNUDKUTFPQ-KUBAVDMBSA-N -HMDB0013631 339.277344055 "Oleoyl glycine" C20H37NO3 HPFXACZRFJDURI-KTKRTIGZSA-N -HMDB0013639 237.085720237 "8-[(Aminomethyl)sulfanyl]-6-sulfanyloctanoic acid" C9H19NO2S2 YNZQCBXDUUGFIX-UHFFFAOYSA-N -HMDB0013674 126.031694058 1,2,3-Trihydroxybenzene C6H6O3 WQGWDDDVZFFDIG-UHFFFAOYSA-N -HMDB0013675 126.031694058 1,3,5-Trihydroxybenzene C6H6O3 QCDYQQDYXPDABM-UHFFFAOYSA-N -HMDB0013677 154.026608673 "3,5-Dihydroxybenzoic acid" C7H6O4 UYEMGAFJOZZIFP-UHFFFAOYSA-N -HMDB0013678 195.053157781 "4-Hydroxyhippuric acid" C9H9NO4 ZMHLUFWWWPBTIU-UHFFFAOYSA-N -HMDB0013695 228.042258744 "Urolithin A" C13H8O4 RIUPLDUFZCXCHM-UHFFFAOYSA-N -HMDB0013713 246.100442324 N-acetyltryptophan C13H14N2O3 DZTHIGRZJZPRDV-LBPRGKRZSA-N -HMDB0013716 117.078978601 Norvaline C5H11NO2 SNDPXSYFESPGGJ-SCSAIBSYSA-N -HMDB0013749 82.041864814 2-Methylfuran C5H6O VQKFNUFAXTZWDK-UHFFFAOYSA-N -HMDB0013780 125.963162262 "Dimethyl trisulfide" C2H6S3 YWHLKYXPLRWGSE-UHFFFAOYSA-N -HMDB0013785 68.02621475 Furan C4H4O YLQBMQCUIZJEEH-UHFFFAOYSA-N -HMDB0013809 126.10446507 (E)-2-octenal C8H14O LVBXEMGDVWVTGY-UHFFFAOYSA-N -HMDB0013811 146.118103761 1-Nitroheptane C7H16NO2 FVLWFQZJXWIROM-UHFFFAOYSA-N -HMDB0013816 204.151415262 2,4-Di-tert-butylphenol C14H20O DFAHCHKNTOVDQQ-UHFFFAOYSA-N -HMDB0013824 138.10446507 2-Pentylfuran C9H14O YVBAUDVGOFCUSG-UHFFFAOYSA-N -HMDB0013825 206.167065326 4-(1,1,3,3-Tetramethylbutyl)-phenol C14H22O ISAVYTVYFVQUDY-UHFFFAOYSA-N -HMDB0014389 153.042593095 Mesalazine C7H7NO3 KBOPZPXVLCULAV-UHFFFAOYSA-N -HMDB0014417 111.079647303 Betazole C5H9N3 JXDFEQONERDKSS-UHFFFAOYSA-N -HMDB0014426 234.173213336 Lidocaine C14H22N2O NNJVILVZKWQKPM-UHFFFAOYSA-N -HMDB0014487 414.16132802 Diltiazem C22H26N2O4S HSUGRBWQSSZJOP-RTWAWAEBSA-N -HMDB0014839 505.224656557 Amprenavir C25H35N3O6S YMARZQAQMVYCKC-OEMFJLHTSA-N -HMDB0015044 324.183778022 Quinidine C20H24N2O2 LOUPRKONTZGTKE-LHHVKLHASA-N -HMDB0015166 285.103478791 Probenecid C13H19NO4S DBABZHXKTCFAPX-UHFFFAOYSA-N -HMDB0028680 160.08479226 Alanyl-Alanine C6H12N2O3 DEFJQIDDEAULHB-UHFFFAOYSA-N -HMDB0028686 218.090271559 "Alanyl-Glutamic acid" C8H14N2O5 VYZAGTDAHUIRQA-UHFFFAOYSA-N -HMDB0028689 226.106590334 Alanyl-Histidine C9H14N4O3 XZWXFWBHYRFLEF-UHFFFAOYSA-N -HMDB0028690 202.131742452 Alanyl-Isoleucine C9H18N2O3 ZSOICJZJSRWNHX-UHFFFAOYSA-N -HMDB0028691 202.131742452 Alanyl-Leucine C9H18N2O3 RDIKFPRVLJLMER-UHFFFAOYSA-N -HMDB0028694 236.116092388 Alanyl-Phenylalanine C12H16N2O3 OMNVYXHOSHNURL-UHFFFAOYSA-N -HMDB0028695 186.100442324 Alanyl-Proline C8H14N2O3 WPWUFUBLGADILS-UHFFFAOYSA-N -HMDB0028697 190.095356946 Alanyl-Threonine C7H14N2O4 BUQICHWNXBIBOG-UHFFFAOYSA-N -HMDB0028699 252.11100701 Alanyl-Tyrosine C12H16N2O4 ALZVPLKYDKJKQU-UHFFFAOYSA-N -HMDB0028700 188.116092383 Alanyl-Valine C8H16N2O3 LIWMQSWFLXEGMA-WDSKDSINSA-N -HMDB0028712 287.195739691 Arginyl-Isoleucine C12H25N5O3 QYLJIYOGHRGUIH-UHFFFAOYSA-N -HMDB0028713 287.195739691 Arginyl-Leucine C12H25N5O3 WYBVBIHNJWOLCJ-UHFFFAOYSA-N -HMDB0028715 305.152160317 Arginyl-Methionine C11H23N5O3S ROWCTNFEMKOIFQ-UHFFFAOYSA-N -HMDB0028716 321.180089627 Arginyl-Phenylalanine C15H23N5O3 PQBHGSGQZSOLIR-UHFFFAOYSA-N -HMDB0028717 271.164439563 Arginyl-Proline C11H21N5O3 LQJAALCCPOTJGB-UHFFFAOYSA-N -HMDB0028721 337.175004249 Arginyl-Tyrosine C15H23N5O4 XTWSWDJMIKUJDQ-UHFFFAOYSA-N -HMDB0028722 273.180089627 Arginyl-Valine C11H23N5O3 DAQIJMOLTMGJLO-UHFFFAOYSA-N -HMDB0028732 245.101170605 Asparaginyl-Hydroxyproline C9H15N3O5 LMVFAFXAMGAFOO-UHFFFAOYSA-N -HMDB0028734 245.137556111 Asparaginyl-Isoleucine C10H19N3O4 MQLZLIYPFDIDMZ-UHFFFAOYSA-N -HMDB0028735 245.137556111 Asparaginyl-Leucine C10H19N3O4 HXWUJJADFMXNKA-UHFFFAOYSA-N -HMDB0028744 231.121906047 Asparaginyl-Valine C9H17N3O4 KWBQPGIYEZKDEG-UHFFFAOYSA-N -HMDB0028757 246.121571696 Aspartyl-Leucine C10H18N2O5 ZVDPYSVOZFINEE-UHFFFAOYSA-N -HMDB0028764 319.116820669 Aspartyl-Tryptophan C15H17N3O5 ZARXTZFGQZBYFO-UHFFFAOYSA-N -HMDB0028795 274.127719696 Glutaminylglutamine C10H18N4O5 LOJYQMFIIJVETK-WDSKDSINSA-N -HMDB0028800 259.153206168 Glutaminylisoleucine C11H21N3O4 XITLYYAIPBBHPX-ZKWXMUAHSA-N -HMDB0028801 259.153206168 Glutaminylleucine C11H21N3O4 ARPVSMCNIDAQBO-YUMQZZPRSA-N -HMDB0028805 243.121906039 Glutaminylproline C10H17N3O4 NJMYZEJORPYOTO-BQBZGAKWSA-N -HMDB0028822 260.137221752 Glutamylisoleucine C11H20N2O5 SNFUTDLOCQQRQD-ZKWXMUAHSA-N -HMDB0028823 260.137221752 Glutamylleucine C11H20N2O5 YBAFDPFAUTYYRW-YUMQZZPRSA-N -HMDB0028830 333.132470724 Glutamyltryptophan C16H19N3O5 LLEUXCDZPQOJMY-AAEUAGOBSA-N -HMDB0028831 310.116486308 Glutamyltyrosine C14H18N2O6 YSWHPLCDIMUKFE-QWRGUYRKSA-N -HMDB0028832 246.121571696 Glutamylvaline C10H18N2O5 SITLTJHOQZFJGG-XPUUQOCRSA-N -HMDB0028844 188.116092388 Glycyl-Isoleucine C8H16N2O3 KGVHCTWYMPWEGN-UHFFFAOYSA-N -HMDB0028847 206.072513014 Glycyl-Methionine C7H14N2O3S PFMUCCYYAAFKTH-UHFFFAOYSA-N -HMDB0028848 222.100442324 Glycyl-Phenylalanine C11H14N2O3 JBCLFWXMTIKCCB-UHFFFAOYSA-N -HMDB0028851 176.079706882 Glycyl-Threonine C6H12N2O4 OLIFSFOFKGKIRH-UHFFFAOYSA-N -HMDB0028852 261.111341361 Glycyl-Tryptophan C13H15N3O3 AJHCSUXXECOXOY-UHFFFAOYSA-N -HMDB0028853 238.095356939 Glycyltyrosine C11H14N2O4 XBGGUPMXALFZOT-VIFPVBQESA-N -HMDB0028854 174.100442324 Glycyl-Valine C7H14N2O3 STKYPAFSDFAEPH-UHFFFAOYSA-N -HMDB0028878 226.106590334 Histidinyl-Alanine C9H14N4O3 FRJIAZKQGSCKPQ-UHFFFAOYSA-N -HMDB0028885 212.09094027 Histidinyl-Glycine C8H12N4O3 LYCVKHSJGDMDLM-UHFFFAOYSA-N -HMDB0028888 268.153540526 Histidinyl-Isoleucine C12H20N4O3 IDXZDKMBEXLFMB-UHFFFAOYSA-N -HMDB0028889 268.153540526 Histidinyl-Leucine C12H20N4O3 MMFKFJORZBJVNF-UHFFFAOYSA-N -HMDB0028892 302.137890462 Histidinyl-Phenylalanine C15H18N4O3 XMAUFHMAAVTODF-UHFFFAOYSA-N -HMDB0028893 252.122240398 Histidinyl-Proline C11H16N4O3 LNCFUHAPNTYMJB-UHFFFAOYSA-N -HMDB0028896 341.148789499 Histidinyl-Tryptophan C17H19N5O3 FBTYOQIYBULKEH-UHFFFAOYSA-N -HMDB0028898 254.137890462 Histidinyl-Valine C11H18N4O3 VLDVBZICYBVQHB-UHFFFAOYSA-N -HMDB0028900 202.131742452 Isoleucyl-Alanine C9H18N2O3 RCFDOSNHHZGBOY-UHFFFAOYSA-N -HMDB0028901 287.195739691 Isoleucyl-Arginine C12H25N5O3 HYXQKVOADYPQEA-UHFFFAOYSA-N -HMDB0028902 245.137556111 Isoleucyl-Asparagine C10H19N3O4 HZYHBDVRCBDJJV-UHFFFAOYSA-N -HMDB0028903 246.121571696 Isoleucyl-Aspartate C10H18N2O5 WKXVAXOSIPTXEC-UHFFFAOYSA-N -HMDB0028906 260.137221752 Isoleucyl-Glutamate C11H20N2O5 KTGFOCFYOZQVRJ-UHFFFAOYSA-N -HMDB0028907 188.116092388 Isoleucyl-Glycine C8H16N2O3 UCGDDTHMMVWVMV-UHFFFAOYSA-N -HMDB0028910 244.178692644 Isoleucyl-Isoleucine C12H24N2O3 BCVIOZZGJNOEQS-UHFFFAOYSA-N -HMDB0028911 244.178692644 Isoleucyl-Leucine C12H24N2O3 JWBXCSQZLLIOCI-UHFFFAOYSA-N -HMDB0028913 262.13511327 Isoleucyl-Methionine C11H22N2O3S TUYOFUHICRWDGA-UHFFFAOYSA-N -HMDB0028914 278.16304258 Isoleucyl-Phenylalanine C15H22N2O3 WMDZARSFSMZOQO-UHFFFAOYSA-N -HMDB0028916 218.126657074 Isoleucyl-Serine C9H18N2O4 TWVKGYNQQAUNRN-UHFFFAOYSA-N -HMDB0028917 232.142307138 Isoleucyl-Threonine C10H20N2O4 DRCKHKZYDLJYFQ-UHFFFAOYSA-N -HMDB0028918 317.173941617 Isoleucyl-Tryptophan C17H23N3O3 BVRPESWOSNFUCJ-UHFFFAOYSA-N -HMDB0028919 294.157957202 Isoleucyl-Tyrosine C15H22N2O4 MUFXDFWAJSPHIQ-UHFFFAOYSA-N -HMDB0028920 230.16304258 Isoleucyl-Valine C11H22N2O3 BCXBIONYYJCSDF-UHFFFAOYSA-N -HMDB0028922 202.131742452 Leucyl-Alanine C9H18N2O3 HSQGMTRYSIHDAC-UHFFFAOYSA-N -HMDB0028923 287.195739691 Leucyl-Arginine C12H25N5O3 SENJXOPIZNYLHU-UHFFFAOYSA-N -HMDB0028924 245.137556111 Leucyl-Asparagine C10H19N3O4 MLTRLIITQPXHBJ-UHFFFAOYSA-N -HMDB0028927 259.153206175 Leucyl-Glutamine C11H21N3O4 JYOAXOMPIXKMKK-UHFFFAOYSA-N -HMDB0028928 260.137221752 Leucyl-Glutamate C11H20N2O5 NFNVDJGXRFEYTK-UHFFFAOYSA-N -HMDB0028929 188.116092388 Leucyl-Glycine C8H16N2O3 LESXFEZIFXFIQR-UHFFFAOYSA-N -HMDB0028932 244.178692644 Leucyl-Isoleucine C12H24N2O3 AZLASBBHHSLQDB-UHFFFAOYSA-N -HMDB0028933 244.178692644 Leucyl-Leucine C12H24N2O3 LCPYQJIKPJDLLB-UHFFFAOYSA-N -HMDB0028935 262.13511327 Leucyl-Methionine C11H22N2O3S NTISAKGPIGTIJJ-UHFFFAOYSA-N -HMDB0028938 218.126657074 Leucyl-Serine C9H18N2O4 XGDCYUQSFDQISZ-UHFFFAOYSA-N -HMDB0028939 232.142307138 Leucyl-Threonine C10H20N2O4 LRKCBIUDWAXNEG-UHFFFAOYSA-N -HMDB0028940 317.173941617 Leucyl-Tryptophan C17H23N3O3 BQVUABVGYYSDCJ-UHFFFAOYSA-N -HMDB0028941 294.157957202 Leucyl-Tyrosine C15H22N2O4 LHSGPCFBGJHPCY-UHFFFAOYSA-N -HMDB0028942 230.16304258 Leucyl-Valine C11H22N2O3 MDSUKZSLOATHMH-UHFFFAOYSA-N -HMDB0028954 259.189591681 Lysyl-Isoleucine C12H25N3O3 FMIIKPHLJKUXGE-UHFFFAOYSA-N -HMDB0028955 259.189591681 Lysyl-Leucine C12H25N3O3 ATIPDCIQTUXABX-UHFFFAOYSA-N -HMDB0028958 293.173941617 Lysyl-Phenylalanine C15H23N3O3 QCZYYEFXOBKCNQ-UHFFFAOYSA-N -HMDB0028959 243.158291553 Lysyl-Proline C11H21N3O3 AIXUQKMMBQJZCU-UHFFFAOYSA-N -HMDB0028963 309.168856239 Lysyl-Tyrosine C15H23N3O4 MYTOTTSMVMWVJN-UHFFFAOYSA-N -HMDB0028964 245.173941617 Lysyl-Valine C11H23N3O3 YQAIUOWPSUOINN-UHFFFAOYSA-N -HMDB0028966 220.088163078 Methionyl-Alanine C8H16N2O3S JHKXZYLNVJRAAJ-UHFFFAOYSA-N -HMDB0028980 296.119463206 Methionyl-Phenylalanine C14H20N2O3S HGCNKOLVKRAVHD-UHFFFAOYSA-N -HMDB0028983 250.098727764 Methionyl-Threonine C9H18N2O4S KAKJTZWHIUWTTD-UHFFFAOYSA-N -HMDB0028986 248.119463206 Methionyl-Valine C10H20N2O3S BJFJQOMZCSHBMY-UHFFFAOYSA-N -HMDB0028988 236.116092388 Phenylalanyl-Alanine C12H16N2O3 MIDZLCFIAINOQN-UHFFFAOYSA-N -HMDB0028991 280.105921632 Phenylalanyl-Aspartate C13H16N2O5 HWMGTNOVUDIKRE-UHFFFAOYSA-N -HMDB0028994 294.121571688 Phenylalanyl-Glutamate C14H18N2O5 JXWLMUIXUXLIJR-UHFFFAOYSA-N -HMDB0028995 222.100442324 Phenylalanyl-Glycine C11H14N2O3 GLUBLISJVJFHQS-UHFFFAOYSA-N -HMDB0028998 278.16304258 Phenylalanyl-Isoleucine C15H22N2O3 JWBLQDDHSDGEGR-UHFFFAOYSA-N -HMDB0029001 296.119463206 Phenylalanyl-Methionine C14H20N2O3S PYOHODCEOHCZBM-UHFFFAOYSA-N -HMDB0029004 252.11100701 Phenylalanyl-Serine C12H16N2O4 ROHDXJUFQVRDAV-UHFFFAOYSA-N -HMDB0029006 351.158291553 Phenylalanyl-Tryptophan C20H21N3O3 JMCOUWKXLXDERB-UHFFFAOYSA-N -HMDB0029007 328.142307138 Phenylalanyl-Tyrosine C18H20N2O4 FSXRLASFHBWESK-UHFFFAOYSA-N -HMDB0029008 264.147392516 Phenylalanyl-Valine C14H20N2O3 IEHDJWSAXBGJIP-UHFFFAOYSA-N -HMDB0029010 186.100442324 Prolyl-Alanine C8H14N2O3 FELJDCNGZFDUNR-UHFFFAOYSA-N -HMDB0029026 202.095356946 Prolyl-Serine C8H14N2O4 AFWBWPCXSWUCLB-UHFFFAOYSA-N -HMDB0029028 301.142641489 Prolyl-Tryptophan C16H19N3O3 UEKYKRQIAQHOOZ-UHFFFAOYSA-N -HMDB0029042 218.126657074 Serylisoleucine C9H18N2O4 BXLYSRPHVMCOPS-UHFFFAOYSA-N -HMDB0029043 218.126657074 Serylleucine C9H18N2O4 NFDYGNFETJVMSE-UHFFFAOYSA-N -HMDB0029046 252.11100701 Serylphenylalanine C12H16N2O4 PPQRSMGDOHLTBE-UHFFFAOYSA-N -HMDB0029047 202.095356946 Serylproline C8H14N2O4 WBAXJMCUFIXCNI-UHFFFAOYSA-N -HMDB0029052 204.11100701 Serylvaline C8H16N2O4 ILVGMCVCQBJPSH-UHFFFAOYSA-N -HMDB0029064 232.142307138 Threoninyl-Isoleucine C10H20N2O4 LUMXICQAOKVQOB-UHFFFAOYSA-N -HMDB0029065 232.142307138 Threoninyl-Leucine C10H20N2O4 BQBCIBCLXBKYHW-UHFFFAOYSA-N -HMDB0029068 266.126657074 Threoninyl-Phenylalanine C13H18N2O4 IQHUITKNHOKGFC-UHFFFAOYSA-N -HMDB0029074 218.126657074 Threoninyl-Valine C9H18N2O4 CKHWEVXPLJBEOZ-UHFFFAOYSA-N -HMDB0029076 275.126991425 Tryptophyl-Alanine C14H17N3O3 OHGNSVACHBZKSS-UHFFFAOYSA-N -HMDB0029082 333.132470724 Tryptophyl-Glutamate C16H19N3O5 PWIQCLSQVQBOQV-UHFFFAOYSA-N -HMDB0029083 261.111341361 Tryptophyl-Glycine C13H15N3O3 UYKREHOKELZSPB-UHFFFAOYSA-N -HMDB0029086 317.173941617 Tryptophyl-Isoleucine C17H23N3O3 PITVQFJBUFDJDD-UHFFFAOYSA-N -HMDB0029087 317.173941617 Tryptophyl-Leucine C17H23N3O3 LYMVXFSTACVOLP-UHFFFAOYSA-N -HMDB0029090 351.158291553 Tryptophyl-Phenylalanine C20H21N3O3 IMMPMHKLUUZKAZ-UHFFFAOYSA-N -HMDB0029091 301.142641489 Tryptophyl-Proline C16H19N3O3 DXYQIGZZWYBXSD-UHFFFAOYSA-N -HMDB0029094 390.16919059 Tryptophyl-Tryptophan C22H22N4O3 NQIHMZLGCZNZBN-UHFFFAOYSA-N -HMDB0029095 367.153206175 Tryptophyl-Tyrosine C20H21N3O4 TYYLDKGBCJGJGW-UHFFFAOYSA-N -HMDB0029096 303.158291553 Tryptophyl-Valine C16H21N3O3 LWFWZRANSFAJDR-UHFFFAOYSA-N -HMDB0029098 252.11100701 Tyrosyl-Alanine C12H16N2O4 NLKUJNGEGZDXGO-UHFFFAOYSA-N -HMDB0029103 309.132470733 Tyrosyl-Glutamine C14H19N3O5 UBAQSAUDKMIEQZ-UHFFFAOYSA-N -HMDB0029104 310.116486308 Tyrosyl-Glutamate C14H18N2O6 PDSLRCZINIDLMU-UHFFFAOYSA-N -HMDB0029106 294.121571696 Tyrosyl-Hydroxyproline C14H18N2O5 FTWOPDCJCRFTHX-UHFFFAOYSA-N -HMDB0029108 294.157957202 Tyrosyl-Isoleucine C15H22N2O4 QJKMCQRFHJRIPU-UHFFFAOYSA-N -HMDB0029109 294.157957202 Tyrosyl-Leucine C15H22N2O4 AUEJLPRZGVVDNU-UHFFFAOYSA-N -HMDB0029112 328.142307138 Tyrosyl-Phenylalanine C18H20N2O4 CGWAPUBOXJWXMS-UHFFFAOYSA-N -HMDB0029117 344.13722176 Tyrosyl-Tyrosine C18H20N2O5 JAQGKXUEKGKTKX-UHFFFAOYSA-N -HMDB0029118 280.142307138 Tyrosyl-Valine C14H20N2O4 OYOQKMOWUDVWCR-UHFFFAOYSA-N -HMDB0029120 188.116092388 Valyl-Alanine C8H16N2O3 HSRXSKHRSXRCFC-UHFFFAOYSA-N -HMDB0029121 273.180089627 Valyl-Arginine C11H23N5O3 IBIDRSSEHFLGSD-UHFFFAOYSA-N -HMDB0029123 232.105921632 Valyl-Aspartate C9H16N2O5 OBTCMSPFOITUIJ-UHFFFAOYSA-N -HMDB0029125 245.137556111 Valyl-Glutamine C10H19N3O4 XXDVDTMEVBYRPK-UHFFFAOYSA-N -HMDB0029126 246.121571688 Valyl-Glutamate C10H18N2O5 UPJONISHZRADBH-UHFFFAOYSA-N -HMDB0029127 174.100442324 Valyl-Glycine C7H14N2O3 IOUPEELXVYPCPG-UHFFFAOYSA-N -HMDB0029129 254.137890462 Valyl-Histidine C11H18N4O3 BNQVUHQWZGTIBX-UHFFFAOYSA-N -HMDB0029130 230.16304258 Valyl-Isoleucine C11H22N2O3 PNVLWFYAPWAQMU-UHFFFAOYSA-N -HMDB0029131 230.16304258 Valyl-Leucine C11H22N2O3 XCTHZFGSVQBHBW-UHFFFAOYSA-N -HMDB0029132 245.173941617 Valyl-Lysine C11H23N3O3 JKHXYJKMNSSFFL-UHFFFAOYSA-N -HMDB0029133 248.119463206 Valyl-Methionine C10H20N2O3S YSGSDAIMSCVPHG-UHFFFAOYSA-N -HMDB0029134 264.147392516 Valyl-Phenylalanine C14H20N2O3 GJNDXQBALKCYSZ-UHFFFAOYSA-N -HMDB0029136 204.11100701 Valyl-Serine C8H16N2O4 STTYIMSDIYISRG-UHFFFAOYSA-N -HMDB0029137 218.126657074 Valyl-Threonine C9H18N2O4 GVRKWABULJAONN-UHFFFAOYSA-N -HMDB0029138 303.158291553 Valyl-Tryptophan C16H21N3O3 LZDNBBYBDGBADK-UHFFFAOYSA-N -HMDB0029139 280.142307138 Valyl-Tyrosine C14H20N2O4 VEYJKJORLPYVLO-UHFFFAOYSA-N -HMDB0029140 216.147392516 Valyl-Valine C10H20N2O3 KRNYOVHEKOBTEF-UHFFFAOYSA-N -HMDB0029147 275.111735279 N-gamma-Glutamylglutamine C10H17N3O6 FCWNOQOVMGNKNG-WDSKDSINSA-N -HMDB0029151 284.112069631 gamma-Glutamylhistidine C11H16N4O5 PXVCMZCJAUJLJP-YUMQZZPRSA-N -HMDB0029160 333.132470724 gamma-Glutamyltryptophan C16H19N3O5 CATMPQFFVNKDEY-AAEUAGOBSA-N -HMDB0029167 160.073558872 "2-Methyladipic acid" C7H12O4 JZUMVFMLJGSMRF-UHFFFAOYSA-N -HMDB0029185 208.073558872 5-(3',4'-Dihydroxyphenyl)-gamma-valerolactone C11H12O4 ZNXXWTPQHVLMQT-UHFFFAOYSA-N -HMDB0029196 164.068473494 D-Fucose C6H12O5 SHZGCJCMOBCMKK-PHYPRBDBSA-N -HMDB0029205 635.488990111 lysoPC(26:0) C34H70NO7P WSDKRPCAPHRNNZ-MGBGTMOVSA-N -HMDB0029206 663.520290239 lysoPC(28:0) C36H74NO7P VPAMUPUPKCTFGJ-PGUFJCEWSA-N -HMDB0029216 715.575399814 "SM C16:1" C40H80N2O6P ZKIVREDSEABFBU-NDBDZNEVSA-O -HMDB0029220 633.473340047 lysoPC(26:1(5Z)) C34H68NO7P HHNUOPXCCKOIPL-VTFFUMFSSA-N -HMDB0029221 661.504640175 lysoPC(28:1(5Z)) C36H72NO7P VCXKVGMRVJRCIV-XRKADIMJSA-N -HMDB0029223 179.094628665 alpha-Methylphenylalanine C10H13NO2 HYOWVAAEQCNGLE-UHFFFAOYSA-N -HMDB0029224 179.094628665 N-methylphenylalanine C10H13NO2 SCIFESDRCALIIM-UHFFFAOYSA-N -HMDB0029377 285.136493479 Piperine C17H19NO3 MXXWOMGUGJBKIW-YPCIICBESA-N -HMDB0029412 159.089543287 Betonicine C7H13NO3 MUNWAHDYFVYIKH-RITPCOANSA-N -HMDB0029415 179.025228471 S-Carboxymethyl-L-cysteine C5H9NO4S GBFLZEXEOZUWRN-UHFFFAOYSA-N -HMDB0029423 161.068807845 Acetylhomoserine C6H11NO4 FCXZBWSIAGGPCB-UHFFFAOYSA-N -HMDB0029595 128.15650064 Nonane C9H20 BKIMMITUMNQMOS-UHFFFAOYSA-N -HMDB0029596 117.914383153 Chloroform CHCl3 HEDRZPFGACZZDS-UHFFFAOYSA-N -HMDB0029597 84.093900384 Cyclohexane C6H12 XDTMQSROBMDMFD-UHFFFAOYSA-N -HMDB0029600 86.109550448 Hexane C6H14 VLKZOEOYAKHREP-UHFFFAOYSA-N -HMDB0029603 72.093900384 Pentane C5H12 OFBQJSOFQDEBGM-UHFFFAOYSA-N -HMDB0029632 268.276615774 "Oleyl alcohol" C18H36O ALSTYHKOOCGGFT-KTKRTIGZSA-N -HMDB0029638 120.057514878 4-Methylbenzaldehyde C8H8O FXLOVSHXALFLKQ-UHFFFAOYSA-N -HMDB0029641 132.093900384 p-Mentha-1,3,5,8-tetraene C10H12 MMSLOZQEMPDGPI-UHFFFAOYSA-N -HMDB0029649 170.021523302 "2,4,6-Trihydroxybenzoic acid" C7H6O5 IBHWREHFNDMRPR-UHFFFAOYSA-N -HMDB0029672 138.068079564 1,3-Dimethoxybenzene C8H10O2 DPZNOMCNRMUKPS-UHFFFAOYSA-N -HMDB0029718 84.003370818 Thiophene C4H4S YTPLMLYBLZKORZ-UHFFFAOYSA-N -HMDB0029723 182.999013721 Saccharin C7H5NO3S CVHZOJJKTDOEJC-UHFFFAOYSA-N -HMDB0029728 110.073164942 2-Ethyl-5-methylfuran C7H10O NBXLPPVOZWYADY-UHFFFAOYSA-N -HMDB0029738 189.078978601 "Indole-3-methyl acetate" C11H11NO2 KTHADMDGDNYQRX-UHFFFAOYSA-N -HMDB0029750 126.031694058 "Methyl 2-furoate" C6H6O3 HDJLSECJEQSPKW-UHFFFAOYSA-N -HMDB0029751 128.062600256 Naphthalene C10H8 UFWIBTONFRDIAS-UHFFFAOYSA-N -HMDB0029762 116.083729628 "Methyl (S)-2-Methylbutanoate" C6H12O2 OCWLYWIFNDCWRZ-UHFFFAOYSA-N -HMDB0029811 284.271530396 "Ethyl hexadecanoate" C18H36O2 XIRNKXNNONJFQO-UHFFFAOYSA-N -HMDB0029817 166.062994186 "Ethyl salicylate" C9H10O3 GYCKQBWUSACYIF-UHFFFAOYSA-N -HMDB0029937 504.169034976 Panose C18H32O16 OWEGMIWEEQEYGQ-UHFFFAOYSA-N -HMDB0029942 150.05282343 D-Arabinose C5H10O5 PYMYPHUHKUWMLA-WDCZJNDASA-N -HMDB0029980 144.115029756 "Hexyl acetate" C8H16O2 AOGQPLXWSUTHQB-UHFFFAOYSA-N -HMDB0030021 412.370516158 Fucosterol C29H48O OSELKOCHBMDKEJ-ZMRGBFEOSA-N -HMDB0030025 90.013935504 1-Mercapto-2-propanone C3H6OS USVCRBGYQRVTNK-UHFFFAOYSA-N -HMDB0030027 116.083729628 "Methyl 3-methylbutanoate" C6H12O2 OQAGVSWESNCJJT-UHFFFAOYSA-N -HMDB0030028 130.099379692 "Ethyl isovalerate" C7H14O2 PPXUHEORWJQRHJ-UHFFFAOYSA-N -HMDB0030052 130.099379692 "Butyl propionate" C7H14O2 BTMVHUNTONAYDX-UHFFFAOYSA-N -HMDB0030056 116.083729628 "Isopropyl propionate" C6H12O2 IJMWOMHMDSDKGK-UHFFFAOYSA-N -HMDB0030058 102.068079564 "Ethyl propionate" C5H10O2 FKRCODPIKNYEAC-UHFFFAOYSA-N -HMDB0030059 116.083729628 "Propyl propionate" C6H12O2 MCSINKKTEDDPNK-UHFFFAOYSA-N -HMDB0030060 164.083729628 "Methyl 3-phenylpropanoate" C10H12O2 RPUSRLKKXPQSGP-UHFFFAOYSA-N -HMDB0030062 88.0524295 "Methyl propionate" C4H8O2 RJUFJBKOKNCXHH-UHFFFAOYSA-N -HMDB0030070 130.135765198 (S)-3-Octanol C8H18O NMRPBPVERJPACX-UHFFFAOYSA-N -HMDB0030124 86.073164942 Prenol C5H10O ASUAYTHWZCLXAN-UHFFFAOYSA-N -HMDB0030126 86.073164942 3-Methyl-3-buten-1-ol C5H10O CPJRRXSHAYUTGL-UHFFFAOYSA-N -HMDB0030180 480.308703762 Crustecdysone C27H44O7 NKDFYOWSKOHCCO-YPVLXUMRSA-N -HMDB0030307 184.219100896 2,6,8-Trimethyldecane C13H28 SWDJLVOSNCGQGB-UHFFFAOYSA-N -HMDB0030331 158.13067982 "xi-2-Ethylheptanoic acid" C9H18O2 DYWSVUBJGFTOQC-UHFFFAOYSA-N -HMDB0030433 273.172878985 "Linalyl anthranilate" C17H23NO2 WHIJSULEEDNKPD-UHFFFAOYSA-N -HMDB0030653 354.095082174 "Cryptochlorogenic acid" C16H18O9 GYFFKZTYYAFCTR-JUHZACGLSA-N -HMDB0030667 300.063388116 Chrysoeriol C16H12O6 SCZVLDHREVKTSH-UHFFFAOYSA-N -HMDB0030776 126.031694058 Maltol C6H6O3 XPCTZQVDEJYUGT-UHFFFAOYSA-N -HMDB0030837 148.088815006 Anethole C10H12O RUVINXPYWBROJD-ARJAWSKDSA-N -HMDB0030928 198.198365454 Tridecanal C13H26O BGEHHAVMRVXCGR-UHFFFAOYSA-N -HMDB0030930 182.203450832 1-Tridecene C13H26 VQOXUMQBYILCKR-UHFFFAOYSA-N -HMDB0030941 170.167065326 Undecanal C11H22O KMPQYAYAQWNLME-UHFFFAOYSA-N -HMDB0030942 172.18271539 2-Undecanol C11H24O XMUJIPOFTAHSOK-UHFFFAOYSA-N -HMDB0030998 200.177630012 "Ethyl decanoate" C12H24O2 RGXWDWUGBIJHDO-UHFFFAOYSA-N -HMDB0031019 184.18271539 2-Dodecanone C12H24O LSKONYYRONEBKA-UHFFFAOYSA-N -HMDB0031057 272.23514489 "2-Hydroxyhexadecanoic acid" C16H32O3 JGHSBPIZNUXPLA-OAHLLOKOSA-N -HMDB0031067 270.255880332 "(S)-14-Methylhexadecanoic acid" C17H34O2 FXUKWLSZZHVEJD-UHFFFAOYSA-N -HMDB0031068 256.240230268 "Isopalmitic acid" C16H32O2 ZONJATNKKGGVSU-UHFFFAOYSA-N -HMDB0031072 228.20893014 "12-Methyltridecanoic acid" C14H28O2 YYVJAABUJYRQJO-UHFFFAOYSA-N -HMDB0031078 226.229665582 Pentadecanal C15H30O XGQJZNCFDLXSIJ-UHFFFAOYSA-N -HMDB0031082 210.23475096 1-Pentadecene C15H30 PJLHTVIBELQURV-UHFFFAOYSA-N -HMDB0031189 90.013935504 "S-Methyl thioacetate" C3H6OS OATSQCXMYKYFQO-UHFFFAOYSA-N -HMDB0031191 118.045235632 "S-Methyl butanethioate" C5H10OS GRLJIIJNZJVMGP-UHFFFAOYSA-N -HMDB0031193 176.032087988 "1,2,3-Propanetricarboxylic acid" C6H8O6 KQTIIICEAUMSDG-UHFFFAOYSA-N -HMDB0031206 86.073164942 Pentanal C5H10O HGBOYTHUEUWSSQ-UHFFFAOYSA-N -HMDB0031207 116.083729628 "Methyl pentanoate" C6H12O2 HNBDRPTVWVGKBR-UHFFFAOYSA-N -HMDB0031209 86.036779436 "Ethenyl acetate" C4H6O2 XTXRWKRVRITETP-UHFFFAOYSA-N -HMDB0031213 90.068079564 2-Ethoxyethanol C4H10O2 ZNQVEEAIQZEUHB-UHFFFAOYSA-N -HMDB0031217 88.0524295 "Ethyl acetate" C4H8O2 XEKOWRVHYACXOJ-UHFFFAOYSA-N -HMDB0031230 144.115029756 "2-Ethylhexanoic acid" C8H16O2 OBETXYAYXDNJHR-UHFFFAOYSA-N -HMDB0031231 130.135765198 xi-2-Ethyl-1-hexanol C8H18O YIWUKEYIRIRTPP-UHFFFAOYSA-N -HMDB0031243 72.057514878 2-Methylpropanal C4H8O AMIMRNSIRUDHCM-UHFFFAOYSA-N -HMDB0031248 116.083729628 "Ethyl 2-methylpropanoate" C6H12O2 WDAXFOBOLVPGLV-UHFFFAOYSA-N -HMDB0031249 102.068079564 "Methyl isobutyrate" C5H10O2 BHIWKHZACMWKOJ-UHFFFAOYSA-N -HMDB0031253 102.013935504 Dihydro-2(3H)-thiophenone C4H6OS KMSNYNIWEORQDJ-UHFFFAOYSA-N -HMDB0031265 144.151415262 1-Nonanol C9H20O ZWRUINPWMLAQRD-UHFFFAOYSA-N -HMDB0031266 142.135765198 2-Nonanone C9H18O VKCYHJWLYTUGCC-UHFFFAOYSA-N -HMDB0031269 140.120115134 2-Nonenal C9H16O BSAIUMLZVGUGKX-FPLPWBNLSA-N -HMDB0031294 128.120115134 2-Octanone C8H16O ZPVFWPFBNIEHGJ-UHFFFAOYSA-N -HMDB0031295 128.120115134 "Ethyl pentyl ketone" C8H16O RHLVCLIPMVJYKS-UHFFFAOYSA-N -HMDB0031299 128.120115134 (R)-1-Octen-3-ol C8H16O VSMOENVRRABVKN-UHFFFAOYSA-N -HMDB0031309 126.10446507 1-Octen-3-one C8H14O KLTVSWGXIAYTHO-UHFFFAOYSA-N -HMDB0031317 108.006741636 Bis(methylthio)methane C3H8S2 LOCDPORVFVOGCR-UHFFFAOYSA-N -HMDB0031321 73.089149357 1-Butylamine C4H11N HQABUPZFAYXKJW-UHFFFAOYSA-N -HMDB0031325 116.083729628 "n-Butyl acetate" C6H12O2 DKPFZGUDAPQIHT-UHFFFAOYSA-N -HMDB0031327 118.099379692 2-Butoxyethanol C6H14O2 POAOYUHQDCAZBD-UHFFFAOYSA-N -HMDB0031342 128.083729628 "Cyclohexanecarboxylic acid" C7H12O2 NZNMSOFKMUBTKW-UHFFFAOYSA-N -HMDB0031343 142.099379692 "Methyl cyclohexanecarboxylate" C8H14O2 ZQWPRMPSCMSAJU-UHFFFAOYSA-N -HMDB0031404 99.104799421 Cyclohexylamine C6H13N PAFZNILMFXTMIY-UHFFFAOYSA-N -HMDB0031409 156.151415262 2-Decanone C10H20O ZAJNGDIORYACQU-UHFFFAOYSA-N -HMDB0031417 142.135765198 2,6-Dimethyl-4-heptanone C9H18O PTTPXKJBFFKCEK-UHFFFAOYSA-N -HMDB0031429 114.10446507 2,4-Dimethyl-3-pentanone C7H14O HXVNBWAKAOHACI-UHFFFAOYSA-N -HMDB0031444 170.203450832 N-Dodecane C12H26 SNRUBQQJIBEYMU-UHFFFAOYSA-N -HMDB0031445 156.187800768 Undecane C11H24 RSJKGSCJYJTIGS-UHFFFAOYSA-N -HMDB0031450 142.172150704 N-Decane C10H22 DIOQZVSQGTUSAI-UHFFFAOYSA-N -HMDB0031472 150.053691828 "Dipropyl disulfide" C6H14S2 ALVPFGSHPUPROW-UHFFFAOYSA-N -HMDB0031475 114.10446507 Heptanal C7H14O FXHGMKSSBGDXIY-UHFFFAOYSA-N -HMDB0031476 128.083729628 2,3-Heptanedione C7H12O2 FJPGAMCQJNLTJC-UHFFFAOYSA-N -HMDB0031478 144.115029756 "Methyl heptanoate" C8H16O2 XNCNNDVCAUWAIT-UHFFFAOYSA-N -HMDB0031479 116.120115134 1-Heptanol C7H16O BBMCTIGTTCKYKF-UHFFFAOYSA-N -HMDB0031481 116.120115134 xi-3-Heptanol C7H16O RZKSECIXORKHQS-UHFFFAOYSA-N -HMDB0031482 114.10446507 3-Heptanone C7H14O NGAZZOYFWWSOGK-UHFFFAOYSA-N -HMDB0031491 114.068079564 2,3-Hexanedione C6H10O2 MWVFCEVNXHTDNF-UHFFFAOYSA-N -HMDB0031492 114.068079564 3,4-Hexanedione C6H10O2 KVFQMAZOBTXCAZ-UHFFFAOYSA-N -HMDB0031496 98.073164942 2-Hexenal C6H10O MBDOYVRWFFCFHM-UHFFFAOYSA-N -HMDB0031507 88.0524295 1-Hydroxy-2-butanone C4H8O2 GFAZHVHNLUBROE-UHFFFAOYSA-N -HMDB0031512 84.057514878 "Tiglic aldehyde" C5H8O ACWQBUSCFPJUPN-HYXAFXHYSA-N -HMDB0031518 134.021523302 "D-Malic acid" C4H6O5 BJEPYKJPYRNKOW-UWTATZPHSA-N -HMDB0031523 74.036779436 "Methyl acetate" C3H6O2 KXKVLQRXCPHEJC-UHFFFAOYSA-N -HMDB0031525 86.073164942 (S)-2-Methylbutanal C5H10O BYGQBDHUGHBGMD-YFKPBYRVSA-N -HMDB0031526 86.073164942 (±)-2-Methylbutanal C5H10O BYGQBDHUGHBGMD-UHFFFAOYSA-N -HMDB0031527 88.088815006 (S)-2-Methyl-1-butanol C5H12O QPRQEDXDYOZYLA-UHFFFAOYSA-N -HMDB0031528 130.099379692 "Isopentyl acetate" C7H14O2 MLFHJEHSLIIPHL-UHFFFAOYSA-N -HMDB0031541 110.073164942 3-Methyl-2-cyclohexen-1-one C7H10O IITQJMYAYSNIMI-UHFFFAOYSA-N -HMDB0031548 83.953355478 Dichloromethane CH2Cl2 YMWUJEATGCHHMB-UHFFFAOYSA-N -HMDB0031549 114.10446507 5-Methyl-2-hexanone C7H14O FFWSICBKRCICMR-UHFFFAOYSA-N -HMDB0031554 396.014550705 Sucralose C12H19Cl3O8 BAQAVOSOZGMPRM-UHFFFAOYSA-N -HMDB0031563 98.073164942 "4-Methyl-3-penten-2-one, 9CI" C6H10O SHOJXDKTYKFBRD-UHFFFAOYSA-N -HMDB0031580 116.083729628 "(±)-2-Methylpentanoic acid" C6H12O2 OVBFMEVBMNZIBR-UHFFFAOYSA-N -HMDB0031582 124.088815006 6-Methyl-3,5-heptadien-2-one C8H12O KSKXSFZGARKWOW-XQRVVYSFSA-N -HMDB0031583 114.140850576 3-Methylheptane C8H18 LAIUFBWHERIJIH-UHFFFAOYSA-N -HMDB0031598 100.0524295 2,3-Pentanedione C5H8O2 TZMFJUDUGYTVRY-UHFFFAOYSA-N -HMDB0031599 88.088815006 2-Pentanol C5H12O JYVLIDXNZAXMDK-UHFFFAOYSA-N -HMDB0031604 86.073164942 (E)-2-Penten-1-ol C5H10O BTSIZIIPFNVMHF-ARJAWSKDSA-N -HMDB0031605 86.073164942 1-Penten-3-ol C5H10O VHVMXWZXFBOANQ-UHFFFAOYSA-N -HMDB0031607 84.057514878 1-Penten-3-one C5H8O JLIDVCMBCGBIEY-UHFFFAOYSA-N -HMDB0031619 146.073164942 2-Phenyl-2-butenal C10H10O DYAOGZLLMZQVHY-MBXJOHMKSA-N -HMDB0031638 144.115029756 "Pentyl propanoate" C8H16O2 TWSRVQVEYJNFKQ-UHFFFAOYSA-N -HMDB0031645 59.037113787 Acetamide C2H5NO DLFVBJFMPXGRIB-UHFFFAOYSA-N -HMDB0031646 102.031694058 "Acetic anhydride" C4H6O3 WFDIJRYMOXRFFG-UHFFFAOYSA-N -HMDB0031648 100.0524295 2,4-Pentanedione C5H8O2 YRKCREAYFQTBPV-UHFFFAOYSA-N -HMDB0031653 88.034670946 3-(Methylthio)-1-propene C4H8S NVLPQIPTCCLBEU-UHFFFAOYSA-N -HMDB0031681 128.083729628 Dihydro-5-propyl-2(3H)-furanone C7H12O2 VLSVVMPLPMNWBH-UHFFFAOYSA-N -HMDB0031716 106.045235632 3-(Methylthio)-1-propanol C4H10OS CZUGFKJYCPYHHV-UHFFFAOYSA-N -HMDB0031857 104.029585568 3-(Methylthio)propanal C4H8OS CLUWOWRTHNNBBU-UHFFFAOYSA-N -HMDB0031872 122.0223917 "Methyl propyl disulfide" C4H10S2 PUCHCUYBORIUSM-UHFFFAOYSA-N -HMDB0031875 139.978812326 "Methyl (methylthio)methyl disulfide" C3H8S3 MYIOBINSHMEDEY-UHFFFAOYSA-N -HMDB0032042 158.13067982 "Butyl 3-methylbutanoate" C9H18O2 AYWJSCLAAPJZEF-UHFFFAOYSA-N -HMDB0032045 172.146329884 "Pentyl 3-methylbutanoate" C10H20O2 QURFFFCYNQXLCU-UHFFFAOYSA-N -HMDB0032047 144.115029756 "Propyl 3-methylbutanoate" C8H16O2 LSJMDWFAADPNAX-UHFFFAOYSA-N -HMDB0032049 182.073164942 Benzophenone C13H10O RWCCWEUUXYIKHB-UHFFFAOYSA-N -HMDB0032055 197.080041233 N-Acetylhistidine C8H11N3O3 KBOJOGQFRVVWBH-UHFFFAOYSA-N -HMDB0032063 150.10446507 4-tert-Butylphenol C10H14O QHPQWRBYOIRBIT-UHFFFAOYSA-N -HMDB0032072 132.057514878 (Z)-3-Phenyl-2-propenal C9H8O KJPRLNWUNMBNBZ-DAXSKMNVSA-N -HMDB0032076 122.073164942 1-Methoxy-4-methylbenzene C8H10O CHLICZRVGGXEOD-UHFFFAOYSA-N -HMDB0032136 138.068079564 2-Methoxy-4-methylphenol C8H10O2 PETRWTHZSKVLRE-UHFFFAOYSA-N -HMDB0032208 275.188529049 "Citronellyl anthranilate" C17H25NO2 LSJVFMHIFWWGDY-UHFFFAOYSA-N -HMDB0032272 144.115029756 "Ethyl 4-methylpentanoate" C8H16O2 OFQRUTMGVBMTFQ-UHFFFAOYSA-N -HMDB0032386 422.23382426 2-Methylacetophenone C20H38O7S HNSDLXPSAYFUHK-UHFFFAOYSA-N -HMDB0032405 114.10446507 3-Methylhexanal C7H14O ZSJUABCTGCNBPF-UHFFFAOYSA-N -HMDB0032425 92.029585568 2-(Methylthio)ethanol C3H8OS WBBPRCNXBQTYLF-UHFFFAOYSA-N -HMDB0032572 152.047344122 Methylparaben C8H8O3 LXCFILQKKLGQFO-UHFFFAOYSA-N -HMDB0032594 152.047344122 "2-(Hydroxymethyl)benzoic acid" C8H8O3 MGMNPSAERQZUIM-UHFFFAOYSA-N -HMDB0032616 224.068473494 "Sinapic acid" C11H12O5 PCMORTLOPMLEFB-ONEGZZNKSA-N -HMDB0032619 122.073164942 1-Phenylethanol C8H10O WAPNOHKVXSQRPX-UHFFFAOYSA-N -HMDB0032623 134.073164942 1-Phenyl-1-propanone C9H10O KRIOVPPHQSLHCZ-UHFFFAOYSA-N -HMDB0032914 96.021129372 2-Furancarboxaldehyde C5H4O2 HYBBIBNJHNGZAN-UHFFFAOYSA-N -HMDB0032972 107.073499293 2,6-Dimethylpyridine C7H9N OISVCGZHLKNMSJ-UHFFFAOYSA-N -HMDB0032980 112.034670946 3,4-Dimethylthiophene C6H8S GPSFYJDZKSRMKZ-UHFFFAOYSA-N -HMDB0032985 143.040484605 5-(2-Hydroxyethyl)-4-methylthiazole C6H9NOS BKAWJIRCKVUVED-UHFFFAOYSA-N -HMDB0033002 110.036779436 5-Methyl-2-furancarboxaldehyde C6H6O2 OUDFNZMQXZILJD-UHFFFAOYSA-N -HMDB0033112 94.053098202 Methylpyrazine C5H6N2 CAWHJQAVHZEVTJ-UHFFFAOYSA-N -HMDB0033113 81.057849229 1-Methylpyrrole C5H7N OXHNLMTVIGZXSG-UHFFFAOYSA-N -HMDB0033116 99.014269855 4-Methylthiazole C4H5NS QMHIMXFNBOYPND-UHFFFAOYSA-N -HMDB0033119 98.019020882 3-Methylthiophene C5H6S QENGPZGAWFQWCZ-UHFFFAOYSA-N -HMDB0033127 110.036779436 2-Acetylfuran C6H6O2 IEMMBWWQXVXBEU-UHFFFAOYSA-N -HMDB0033143 254.126657074 Pyrraline C12H18N2O4 VTYFITADLSVOAS-UHFFFAOYSA-N -HMDB0033161 167.021857653 "2,6-Pyridinedicarboxylic acid" C7H5NO4 WJJMNDUMQPNECX-UHFFFAOYSA-N -HMDB0033167 156.115029756 "Ethyl cyclohexanecarboxylate" C9H16O2 JJOYCHKVKWDMEA-UHFFFAOYSA-N -HMDB0033182 96.057514878 2,5-Dimethylfuran C6H8O GSNUFIFRDBKVIE-UHFFFAOYSA-N -HMDB0033433 157.110278729 (S)-Homostachydrine C8H15NO2 XULZWQRXYTVUTE-ZETCQYMHSA-N -HMDB0033547 126.10446507 3-Octen-2-one C8H14O ZCFOBLITZWHNNC-VOTSOKGWSA-N -HMDB0033561 129.024834541 2-Acetyl-4,5-dihydrothiazole C5H7NOS FZOZFDAMVVEZSJ-UHFFFAOYSA-N -HMDB0033567 196.219100896 Cyclotetradecane C14H28 KATXJJSCAPBIOB-UHFFFAOYSA-N -HMDB0033585 162.993928343 Acesulfame C4H5NO4S YGCFIWIQZPHFLU-UHFFFAOYSA-N -HMDB0033620 172.146329884 "Hexyl butyrate" C10H20O2 XAPCMTMQBXLDBB-UHFFFAOYSA-N -HMDB0033676 102.10446507 (±)-3-Methyl-1-pentanol C6H14O IWTBVKIGCDZRPL-UHFFFAOYSA-N -HMDB0033704 180.063388116 L-Galactose C6H12O6 WQZGKKKJIJFFOK-SVZMEOIVSA-N -HMDB0033713 170.167065326 2-Undecanone C11H22O KYWIYKKSMDLRDC-UHFFFAOYSA-N -HMDB0033714 98.073164942 2-Methyl-2-pentenal C6H10O IDEYZABHVQLHAF-XQRVVYSFSA-N -HMDB0033721 254.297351216 Octadecane C18H38 RZJRJXONCZWCBN-UHFFFAOYSA-N -HMDB0033742 102.068079564 "(S)-2-Methylbutanoic acid" C5H10O2 WLAMNBDJUVNPJU-BYPYZUCNSA-N -HMDB0033745 130.099379692 "Ethyl 2-methylbutyrate" C7H14O2 HCRBXQFHJMCTLF-UHFFFAOYSA-N -HMDB0033752 166.062994186 "3-(2-Hydroxyphenyl)propanoic acid" C9H10O3 CJBDUOMQLFKVQC-UHFFFAOYSA-N -HMDB0033774 116.083729628 "3-Methylpentanoic acid" C6H12O2 IGIDLTISMCAULB-UHFFFAOYSA-N -HMDB0033777 88.088815006 3-Methyl-2-butanol C5H12O MXLMTQWGSQIYOW-UHFFFAOYSA-N -HMDB0033788 228.20893014 "Ethyl dodecanoate" C14H28O2 MMXKVMNBHPAILY-UHFFFAOYSA-N -HMDB0033792 226.266051088 Hexadecane C16H34 DCAYPVUWAIABOU-UHFFFAOYSA-N -HMDB0033837 146.057908808 "Dimethyl succinate" C6H10O4 MUXOBHXGJLMRAB-UHFFFAOYSA-N -HMDB0033840 100.0524295 Dihydro-5-methyl-2(3H)-furanone C5H8O2 GAEKPEKOJKCEMS-UHFFFAOYSA-N -HMDB0033889 116.083729628 "Ethyl butyrate" C6H12O2 OBNCKNCVKJNDBV-UHFFFAOYSA-N -HMDB0033890 102.068079564 "Methyl butyrate" C5H10O2 UUIQMZJEGPQKFD-UHFFFAOYSA-N -HMDB0033896 344.23514489 "Anacardic acid" C22H32O3 KAOMOVYHGLSFHQ-UTOQUPLUSA-N -HMDB0033908 116.120115134 (±)-2-Heptanol C7H16O CETWDUZRCINIHU-UHFFFAOYSA-N -HMDB0033910 120.057514878 Acetophenone C8H8O KWOLFJPFCHCOCG-UHFFFAOYSA-N -HMDB0033916 144.151415262 2-Nonanol C9H20O NGDNVOAEIVQRFH-UHFFFAOYSA-N -HMDB0033933 184.18271539 "Lauric aldehyde" C12H24O HFJRKMMYBMWEAD-UHFFFAOYSA-N -HMDB0033944 122.073164942 2-Phenylethanol C8H10O WRMNZCZEMHIOCP-UHFFFAOYSA-N -HMDB0033962 136.088815006 3-Phenyl-1-propanol C9H12O VAJVDSVGBWFCLW-UHFFFAOYSA-N -HMDB0034006 59.073499293 1-Propylamine C3H9N WGYKZJWCGVVSQN-UHFFFAOYSA-N -HMDB0034029 120.093900384 Isopropylbenzene C9H12 RWGFKTVRMDUZSP-UHFFFAOYSA-N -HMDB0034106 72.998619791 "Methyl isothiocyanate" C2H3NS LGDSHSYDSCRFAB-UHFFFAOYSA-N -HMDB0034121 148.088815006 1-Methoxy-4-(2-propenyl)benzene C10H12O ZFMSMUAANRJZFM-UHFFFAOYSA-N -HMDB0034136 200.177630012 "Octyl butanoate" C12H24O2 PWLNAUNEAKQYLH-UHFFFAOYSA-N -HMDB0034146 283.287514811 Octadecanamide C18H37NO LYRFLYHAGKPMFH-UHFFFAOYSA-N -HMDB0034148 198.198365454 2-Tridecanone C13H26O CYIFVRUOHKNECG-UHFFFAOYSA-N -HMDB0034154 298.28718046 "Methyl stearate" C19H38O2 HPEUJPJOZXNMSJ-UHFFFAOYSA-N -HMDB0034161 144.115029756 "2-Methylpropyl butanoate" C8H16O2 RGFNRWTWDWVHDD-UHFFFAOYSA-N -HMDB0034163 116.083729628 "3-Methylbutyl formate" C6H12O2 XKYICAQFSCFURC-UHFFFAOYSA-N -HMDB0034164 144.115029756 "3-Methylbutyl propanoate" C8H16O2 XAOGXQMKWQFZEM-UHFFFAOYSA-N -HMDB0034165 158.13067982 "Propyl hexanoate" C9H18O2 HTUIWRWYYVBCFT-UHFFFAOYSA-N -HMDB0034168 92.062600256 Toluene C7H8 YXFVVABEGXRONW-UHFFFAOYSA-N -HMDB0034170 122.036779436 2-Hydroxybenzaldehyde C7H6O2 SMQUZDBALVYZAC-UHFFFAOYSA-N -HMDB0034172 152.047344122 "Methyl 2-hydroxybenzoate" C8H8O3 OSWPMRLSEDHDFF-UHFFFAOYSA-N -HMDB0034219 194.07903818 D-Pinitol C7H14O6 DSCFFEYYQKSRSV-KLJZZCKASA-N -HMDB0034220 180.063388116 Levoinositol C6H12O6 CDAISMWEOUEBRE-SHFUYGGZSA-N -HMDB0034227 472.39164553 "alpha-Tocopherol acetate" C31H52O3 ZAKOWWREFLAJOT-UHFFFAOYSA-N -HMDB0034233 70.041864814 (E)-2-Butenal C4H6O MLUCVPSAIODCQM-IHWYPQMZSA-N -HMDB0034235 86.073164942 2-Pentanone C5H10O XNLICIUVMPYHGG-UHFFFAOYSA-N -HMDB0034237 102.068079564 "Propyl acetate" C5H10O2 YKYONYBAUNKHLG-UHFFFAOYSA-N -HMDB0034238 76.034670946 1-Propanethiol C3H8S SUVIGLJNEAMWEG-UHFFFAOYSA-N -HMDB0034239 130.099379692 "2-Methylpropyl propanoate" C7H14O2 FZXRXKLUIMKDEL-UHFFFAOYSA-N -HMDB0034240 104.062600256 Styrene C8H8 PPBRXRYQALVLMV-UHFFFAOYSA-N -HMDB0034252 175.084457909 "2-Aminoheptanedioic acid" C7H13NO4 JUQLUIFNNFIIKC-UHFFFAOYSA-N -HMDB0034283 212.214015518 Tetradecanal C14H28O UHUFTBALEZWWIH-UHFFFAOYSA-N -HMDB0034284 184.219100896 Tridecane C13H28 IIYFAKIEWZDVMP-UHFFFAOYSA-N -HMDB0034289 268.31300128 Nonadecane C19H40 LQERIDTXQFOHKA-UHFFFAOYSA-N -HMDB0034296 310.28718046 "11-Eicosenoic acid" C20H38O2 BITHHVVYSMSWAG-UHFFFAOYSA-N -HMDB0034297 298.250794954 "Ricinoleic acid" C18H34O3 WBHHMMIMDMUBKC-XFXZXTDPSA-N -HMDB0034301 85.089149357 Piperidine C5H11N NQRYJNQNLNOLGT-UHFFFAOYSA-N -HMDB0034367 278.093642862 gamma-Glutamylmethionine C10H18N2O5S RQNSKRXMANOPQY-BQBZGAKWSA-N -HMDB0034606 158.13067982 "Hexyl propionate" C9H18O2 GOKKOFHHJFGZHW-UHFFFAOYSA-N -HMDB0034970 136.125200512 (S)-alpha-Phellandrene C10H16 OGLDWXZKYODSOB-JTQLQIEISA-N -HMDB0034997 204.187800768 beta-Selinene C15H24 YOVSPTNQHMDJAG-UHFFFAOYSA-N -HMDB0035093 156.151415262 D-Citronellol C10H20O QMVPMAAFGQKVCJ-SNVBAGLBSA-N -HMDB0035094 156.151415262 L-Citronellol C10H20O QMVPMAAFGQKVCJ-SNVBAGLBSA-N -HMDB0035226 124.0524295 2-Acetyl-5-methylfuran C7H8O2 KEFJLCGVTHRGAH-UHFFFAOYSA-N -HMDB0035238 130.099379692 "Methyl hexanoate" C7H14O2 NUKZAGXMHTUAFE-UHFFFAOYSA-N -HMDB0035239 98.073164942 4-Hexen-3-one C6H10O FEWIGMWODIRUJM-HWKANZROSA-N -HMDB0035248 108.068748266 2,6-Dimethylpyrazine C6H8N2 HJFZAYHYIWGLNL-UHFFFAOYSA-N -HMDB0035289 108.068748266 2,5-Dimethylpyrazine C6H8N2 LCZUOKDVTBMCMX-UHFFFAOYSA-N -HMDB0035514 191.058243159 "xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid" C10H9NO3 ILGMGHZPXRDCCS-UHFFFAOYSA-N -HMDB0035619 136.125200512 alpha-Carene C10H16 BQOFWKZOCNGFEC-UHFFFAOYSA-N -HMDB0035658 136.125200512 (-)-alpha-Pinene C10H16 GRWFGVWFFZKLTI-RKDXNWHRSA-N -HMDB0035765 156.151415262 p-Menthan-3-ol C10H20O NOOLISFMXDJSKH-UHFFFAOYSA-N -HMDB0035770 150.104465071 5-Isopropyl-2-methylphenol C10H14O RECUKUPTGUEGMW-UHFFFAOYSA-N -HMDB0035833 154.1357652 p-Menth-1-en-4-ol C10H18O WRYLYDPHFGVWKC-UHFFFAOYSA-N -HMDB0035850 136.125200515 alpha-Phellandrene C10H16 OGLDWXZKYODSOB-UHFFFAOYSA-N -HMDB0035851 136.125200512 (R)-alpha-Phellandrene C10H16 OGLDWXZKYODSOB-SNVBAGLBSA-N -HMDB0035913 204.187800768 beta-Farnesene C15H24 JSNRRGGBADWTMC-QINSGFPZSA-N -HMDB0035915 126.10446507 Sulcatone C8H14O UHEPJGULSIKKTP-UHFFFAOYSA-N -HMDB0035924 67.042199165 Pyrrole C4H5N KAESVJOAVNADME-UHFFFAOYSA-N -HMDB0036065 204.187800768 alpha-Farnesene C15H24 CXENHBSYCFFKJS-DZKMRSEMSA-N -HMDB0036081 136.125200515 beta-Phellandrene C10H16 LFJQCDVYDGGFCH-UHFFFAOYSA-N -HMDB0036100 154.1357652 3,7-Dimethyl-1,6-octadien-3-ol C10H18O CDOSHBSSFJOMGT-UHFFFAOYSA-N -HMDB0036101 154.135765198 (R)-3,7-Dimethyl-1,6-octadien-3-ol C10H18O CDOSHBSSFJOMGT-SNVBAGLBSA-N -HMDB0036102 154.135765198 D-Linalool C10H18O CDOSHBSSFJOMGT-SNVBAGLBSA-N -HMDB0036163 204.187800773 beta-Sesquiphellandrene C15H24 PHWISBHSBNDZDX-UHFFFAOYSA-N -HMDB0036209 130.099379692 "Propyl 2-methylpropanoate" C7H14O2 AZFUASHXSOTBNU-UHFFFAOYSA-N -HMDB0036228 172.146329884 "2-Methylpropyl hexanoate" C10H20O2 UXUPPWPIGVTVQI-UHFFFAOYSA-N -HMDB0036323 686.278585424 "Secoisolariciresinol 9,9'-diglucoside" C32H46O16 SBVBJPHMDABKJV-UHFFFAOYSA-N -HMDB0036413 204.187800768 alpha-Cubebene C15H24 XUEHVOLRMXNRKQ-UHFFFAOYSA-N -HMDB0036453 200.15650064 3,4-Dihydrocadalene C15H20 CUUMXRBKJIDIAY-UHFFFAOYSA-N -HMDB0036467 204.187800768 alpha-Humulene C15H24 FAMPSKZZVDUYOS-KXWHQPPKSA-N -HMDB0036559 136.125200512 (-)-beta-Pinene C10H16 WTARULDDTDQWMU-IUCAKERBSA-N -HMDB0036560 136.125200515 beta-Pinene C10H16 WTARULDDTDQWMU-UHFFFAOYSA-N -HMDB0036574 75.94414138 "Carbon disulfide" CS2 QGJOPFRUJISHPQ-UHFFFAOYSA-N -HMDB0036657 426.386166222 Epi-alpha-amyrin C30H50O FSLPMRQHCOLESF-QJYIJPODSA-N -HMDB0036678 204.187800768 alpha-Bergamotene C15H24 YMBFCQPIMVLNIU-GRKKQISMSA-N -HMDB0036792 204.187800773 beta-Caryophyllene C15H24 NPNUFJAVOOONJE-GFUGXAQUSA-N -HMDB0036994 136.125200515 Terpinolene C10H16 MOYAFQVGZZPNRA-UHFFFAOYSA-N -HMDB0037013 134.109550448 p-Mentha-1,3,8-triene C10H14 XNMPFDIYAMOYRM-UHFFFAOYSA-N -HMDB0037020 156.151415262 p-Menthan-1-ol C10H20O CMLYGGFIXXLYQT-UHFFFAOYSA-N -HMDB0037050 134.109550448 1-Isopropyl-2-methylbenzene C10H14 WWRCMNKATXZARA-UHFFFAOYSA-N -HMDB0037051 134.109550448 1-Isopropyl-3-methylbenzene C10H14 XCYJPXQACVEIOS-UHFFFAOYSA-N -HMDB0037396 300.266445018 "xi-10-Hydroxyoctadecanoic acid" C18H36O3 PAZZVPKITDJCPV-UHFFFAOYSA-N -HMDB0037788 84.057514878 xi-2,3-Dihydro-3-methylfuran C5H8O GLXIOXNPORODGG-UHFFFAOYSA-N -HMDB0038040 158.13067982 "2-Methylpropyl 3-methylbutanoate" C9H18O2 KEBDNKNVCHQIJU-UHFFFAOYSA-N -HMDB0038169 136.125200515 7-Methyl-3-methylene-1,6-octadiene C10H16 UAHWPYUMFXYFJY-UHFFFAOYSA-N -HMDB0038602 172.146329884 "Octyl acetate" C10H20O2 YLYBTZIQSIBWLI-UHFFFAOYSA-N -HMDB0038666 290.090271568 "L-N-(1H-Indol-3-ylacetyl)aspartic acid" C14H14N2O5 VAFNMNRKDDAKRM-UHFFFAOYSA-N -HMDB0039095 130.099379692 "Pentyl acetate" C7H14O2 PGMYKACGEOXYJE-UHFFFAOYSA-N -HMDB0039216 158.13067982 "Butyl 2-methylbutanoate" C9H18O2 OTKQNSSMCDLVQV-UHFFFAOYSA-N -HMDB0039229 257.101170605 Pyro-L-glutaminyl-L-glutamine C10H15N3O5 ILAITOFTZJRIFJ-WDSKDSINSA-N -HMDB0039618 130.099379692 "Propyl butyrate" C7H14O2 HUAZGNHGCJGYNP-UHFFFAOYSA-N -HMDB0039619 130.099379692 "Isopropyl butyrate" C7H14O2 FFOPEPMHKILNIT-UHFFFAOYSA-N -HMDB0039620 144.115029756 "Butyl butyrate" C8H16O2 XUPYJHCZDLZNFP-UHFFFAOYSA-N -HMDB0039843 132.060885696 "S-Methyl 3-methylthiobutyrate" C6H12OS MPLWTJZAFOVXKP-UHFFFAOYSA-N -HMDB0040209 144.115029756 "Ethyl hexanoate" C8H16O2 SHZIWNPUGXLXDT-UHFFFAOYSA-N -HMDB0040211 172.146329884 "Butyl hexanoate" C10H20O2 RPRPDTXKGSIXMD-UHFFFAOYSA-N -HMDB0040221 158.13067982 "Isoamyl butyrate" C9H18O2 PQLMXFQTAMDXIZ-UHFFFAOYSA-N -HMDB0040240 154.081621138 2-Pentylthiophene C9H14S NOYVOSGVFSEKPR-UHFFFAOYSA-N -HMDB0040272 124.088815006 2-Butylfuran C8H12O NWZIYQNUCXUJJJ-UHFFFAOYSA-N -HMDB0040295 158.13067982 "Butyl pentanoate" C9H18O2 OKJADYKTJJGKDX-UHFFFAOYSA-N -HMDB0040296 144.115029756 "Propyl pentanoate" C8H16O2 ROJKPKOYARNFNB-UHFFFAOYSA-N -HMDB0040297 130.099379692 "Ethyl pentanoate" C7H14O2 ICMAFTSLXCXHRK-UHFFFAOYSA-N -HMDB0040575 102.068079564 "Butyl formate" C5H10O2 NMJJFJNHVMGPGM-UHFFFAOYSA-N -HMDB0040726 170.13067982 "(±)-cis-Linalyl oxide" C10H18O2 BRHDDEIRQPDPMG-PSASIEDQSA-N -HMDB0040733 136.0524295 "Phenyl acetate" C8H8O2 IPBVNPXQWQGGJP-UHFFFAOYSA-N -HMDB0041011 152.120115134 beta-Cyclocitral C10H16O MOQGCGNUWBPGTQ-UHFFFAOYSA-N -HMDB0041389 120.006741636 "Methyl 2-propenyl disulfide" C4H8S2 XNZOTQPMYMCTBZ-UHFFFAOYSA-N -HMDB0041607 138.068079562 2-Phenoxyethanol C8H10O2 QCDWFXQBSFUVSP-UHFFFAOYSA-N -HMDB0041623 411.150246044 N6-Carbamoyl-L-threonyladenosine C15H21N7O7 GYCVHQYQICRFAX-CKTDUXNWSA-N -HMDB0041633 136.125200512 (-)-beta-Phellandrene C10H16 LFJQCDVYDGGFCH-JTQLQIEISA-N -HMDB0041634 136.125200512 (+)-beta-Phellandrene C10H16 LFJQCDVYDGGFCH-JTQLQIEISA-N -HMDB0041822 56.02621475 Acrolein C3H4O HGINCPLSRVDWNT-UHFFFAOYSA-N -HMDB0041842 204.126263144 Bufotenin C12H16N2O VTTONGPRPXSUTJ-UHFFFAOYSA-N -HMDB0041932 179.131014171 Methylephedrine C11H17NO FMCGSUUBYTWNDP-UHFFFAOYSA-N -HMDB0041971 145.969005542 P-Dichlorobenzene C6H4Cl2 OCJBOOLMMGQPQU-UHFFFAOYSA-N -HMDB0042063 750.673740618 TG(14:0/14:0/16:0) C47H90O6 AMXRERGJDVUTMF-SJARJILFSA-N -HMDB0042068 720.626790425 TG(14:0/14:0/14:1(9Z)) C45H84O6 DOEBPNOTMREOMP-FZTZZYPMSA-N -HMDB0042092 750.673740618 TG(14:0/15:0/15:0) C47H90O6 ROBJWPSKKQDYDD-SJARJILFSA-N -HMDB0042121 750.673740612 TG(14:0/16:0/14:0) C47H90O6 UXWDTZNNQVHGSG-UHFFFAOYSA-N -HMDB0042135 888.814591198 TG(14:0/16:0/24:1(15Z)) C57H108O6 ABNSWGKFFQUIAR-KAESFFBXSA-N -HMDB0042143 852.720690811 TG(14:0/16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C55H96O6 DBIJZZLMYBLAQP-WLYRKDTMSA-N -HMDB0042148 852.720690811 TG(14:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C55H96O6 PDOWBMFLISSQRT-BAWFBKEMSA-N -HMDB0042163 856.75199094 TG(14:0/18:0/20:3(5Z,8Z,11Z)) C55H100O6 RVRHSALQSYBGAG-BWCQLJFBSA-N -HMDB0042164 888.814591198 TG(14:0/18:0/22:1(13Z)) C57H108O6 BXFHKVOMHBKGBJ-ULQCEOSSSA-N -HMDB0042165 916.845891326 TG(14:0/18:0/24:1(15Z)) C59H112O6 WDOQOSSKIJDAOB-LIZMGIQCSA-N -HMDB0042169 856.75199094 TG(14:0/18:0/20:3n6) C55H100O6 ZYFACDKCDVPZSE-DYFNGAEKSA-N -HMDB0042172 882.767641004 TG(14:0/18:0/22:4(7Z,10Z,13Z,16Z)) C57H102O6 XEOFILXSSITART-MCSSEQPZSA-N -HMDB0042173 880.75199094 TG(14:0/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C57H100O6 HJBSNTKEHJKZIB-KKMCUQKISA-N -HMDB0042177 852.720690811 TG(14:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C55H96O6 JYQXYTFYWDKLPT-JLHNSBSWSA-N -HMDB0042178 880.75199094 TG(14:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C57H100O6 IEIOCZLRHWBWAA-KWJYYFBQSA-N -HMDB0042192 888.814591198 TG(14:0/20:0/20:1(11Z)) C57H108O6 WEUNTUVUAWDABH-ULQCEOSSSA-N -HMDB0042193 884.783291069 TG(14:0/20:0/20:3(5Z,8Z,11Z)) C57H104O6 MPHCGZMQUSAMKJ-VVCUYWKZSA-N -HMDB0042194 916.845891326 TG(14:0/20:0/22:1(13Z)) C59H112O6 MZXXNIIBQUJJGT-LIZMGIQCSA-N -HMDB0042197 856.75199094 TG(14:0/20:0/18:3(6Z,9Z,12Z)) C55H100O6 AWDHZZVHWUIZSY-MCMWNUHLSA-N -HMDB0042199 884.783291069 TG(14:0/20:0/20:3n6) C57H104O6 SENTUJWTPLLHAV-TVXYYDOCSA-N -HMDB0042200 882.767641004 TG(14:0/20:0/20:4(5Z,8Z,11Z,14Z)) C57H102O6 XJKXBTKTOXZQFL-OGCNKRQBSA-N -HMDB0042201 914.830241262 TG(14:0/20:0/22:2(13Z,16Z)) C59H110O6 RCZREYIMELSGSA-KNAYTQRDSA-N -HMDB0042204 856.75199094 TG(14:0/20:0/18:3(9Z,12Z,15Z)) C55H100O6 LIMGVWSRPUIYTD-JHHRBSFXSA-N -HMDB0042206 882.767641004 TG(14:0/20:0/20:4(8Z,11Z,14Z,17Z)) C57H102O6 GEYNVUPCUDZJMH-QPAZPBKESA-N -HMDB0042207 880.75199094 TG(14:0/20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C57H100O6 QVTBPCIHCQQWGM-XDWOALPCSA-N -HMDB0042220 888.814591198 TG(14:0/22:0/18:1(11Z)) C57H108O6 HOPNBDYQIPEPJT-AEGUMOJNSA-N -HMDB0042221 888.814591198 TG(14:0/22:0/18:1(9Z)) C57H108O6 KGVRIPFAUKNKTG-LCJXGUSNSA-N -HMDB0042222 916.845891326 TG(14:0/22:0/20:1(11Z)) C59H112O6 VAGKZVNTAZNDGU-WOGGMIHASA-N -HMDB0042225 972.908491584 TG(14:0/22:0/24:1(15Z)) C63H120O6 NSFHIRVYTDSVSD-HFGOSKLVSA-N -HMDB0042227 884.783291069 TG(14:0/22:0/18:3(6Z,9Z,12Z)) C57H104O6 BLXQIUODGKBTGK-LCWYSKTQSA-N -HMDB0042228 914.830241262 TG(14:0/22:0/20:2n6) C59H110O6 SDBSYLMJMSWVJK-KIMIJDTCSA-N -HMDB0042231 942.861541391 TG(14:0/22:0/22:2(13Z,16Z)) C61H114O6 NFQQJRGJJVQGAV-QJPSUNIMSA-N -HMDB0042232 938.830241262 TG(14:0/22:0/22:4(7Z,10Z,13Z,16Z)) C61H110O6 OWUCYMBXHHXZRL-PYJJMNJSSA-N -HMDB0042234 884.783291069 TG(14:0/22:0/18:3(9Z,12Z,15Z)) C57H104O6 RYZULKIDHZXLHX-SKOKRVOXSA-N -HMDB0042235 882.767641004 TG(14:0/22:0/18:4(6Z,9Z,12Z,15Z)) C57H102O6 JADYBVKYENQSPF-STNIKBRNSA-N -HMDB0042249 888.814591198 TG(14:0/24:0/16:1(9Z)) C57H108O6 HPJWNEPHGPSMML-AEGUMOJNSA-N -HMDB0042250 916.845891326 TG(14:0/24:0/18:1(11Z)) C59H112O6 XOKFJRGPQQOMMF-SKYDHSLNSA-N -HMDB0042251 916.845891326 TG(14:0/24:0/18:1(9Z)) C59H112O6 VCRFEZPIACRCNR-JAIQLVPXSA-N -HMDB0042253 940.845891326 TG(14:0/24:0/20:3(5Z,8Z,11Z)) C61H112O6 LETIJHNTNHPKEB-UHHIIOKNSA-N -HMDB0042254 972.908491584 TG(14:0/24:0/22:1(13Z)) C63H120O6 KWBNOUOFUVIQGL-HBFRPXMKSA-N -HMDB0042256 914.830241262 TG(14:0/24:0/18:2(9Z,12Z)) C59H110O6 LWNAPQADTXCNTE-VGDHFZSHSA-N -HMDB0042258 942.861541391 TG(14:0/24:0/20:2n6) C61H114O6 CUQAJKYGEQUKMM-GEHBLPSASA-N -HMDB0042259 940.845891326 TG(14:0/24:0/20:3n6) C61H112O6 ZXABCMZUYUPINF-TVCAPLPFSA-N -HMDB0042260 938.830241262 TG(14:0/24:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 ZRUKEJWPGFFHOE-SNNTZUALSA-N -HMDB0042261 970.89284152 TG(14:0/24:0/22:2(13Z,16Z)) C63H118O6 NDJUOSGUPZFLID-PUAIEPDKSA-N -HMDB0042262 966.861541391 TG(14:0/24:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 ZBAKDZKUJDNKLJ-UIFJXNOLSA-N -HMDB0042263 964.845891326 TG(14:0/24:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 LJKKMUUFGNOAAL-PAPTWNMMSA-N -HMDB0042266 938.830241262 TG(14:0/24:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 BYFGMMQHMLHSEK-IQEITMBBSA-N -HMDB0042268 964.845891326 TG(14:0/24:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 IYXYOIWMWJMTGN-QYNAZUPGSA-N -HMDB0042269 962.830241262 TG(14:0/24:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 SYMRDJKPDMMRLM-DENXNWMJSA-N -HMDB0042271 720.62679042 TG(14:0/14:1(9Z)/14:0) C45H84O6 FSNNOULJUSMJGI-SDXDJHTJSA-N -HMDB0042307 888.814591198 TG(14:0/16:1(9Z)/24:0) C57H108O6 KWFQLWFYKULMGD-AEGUMOJNSA-N -HMDB0042321 856.75199094 TG(14:0/16:1(9Z)/22:2(13Z,16Z)) C55H100O6 FICVIOYVXOEZEN-QPRILOHKSA-N -HMDB0042322 852.720690811 TG(14:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C55H96O6 XOVZBEYRPDKHAL-OOBFHMLASA-N -HMDB0042336 888.814591198 TG(14:0/18:1(11Z)/22:0) C57H108O6 JNAGPKIFCRPVFY-AEGUMOJNSA-N -HMDB0042337 916.845891326 TG(14:0/18:1(11Z)/24:0) C59H112O6 NZEDZJHGVGEWRO-SKYDHSLNSA-N -HMDB0042345 914.830241262 TG(14:0/18:1(11Z)/24:1(15Z)) C59H110O6 XMQODCFBJXQBDV-FRHRWYISSA-N -HMDB0042348 856.75199094 TG(14:0/18:1(11Z)/20:2n6) C55H100O6 BVZUJVWCCYACND-RFTPNAAMSA-N -HMDB0042350 852.720690811 TG(14:0/18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C55H96O6 AMPQNKRQIPPNFC-JUFFAWNHSA-N -HMDB0042351 884.783291069 TG(14:0/18:1(11Z)/22:2(13Z,16Z)) C57H104O6 JBBJXVATNOPWNT-CGBZTZCNSA-N -HMDB0042352 880.75199094 TG(14:0/18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C57H100O6 XLTDBJCJNQRMTH-GJPBRVKDSA-N -HMDB0042356 852.720690811 TG(14:0/18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C55H96O6 JPNVFKJWXNFOKV-SLZXXFFXSA-N -HMDB0042366 888.814591198 TG(14:0/18:1(9Z)/22:0) C57H108O6 SCJKAJUAZPTDRO-LCJXGUSNSA-N -HMDB0042367 916.845891326 TG(14:0/18:1(9Z)/24:0) C59H112O6 RUZNGRCQLAJOGE-JAIQLVPXSA-N -HMDB0042375 914.830241262 TG(14:0/18:1(9Z)/24:1(15Z)) C59H110O6 GJHGQWDONIZQBR-XEFQVAJMSA-N -HMDB0042378 856.75199094 TG(14:0/18:1(9Z)/20:2n6) C55H100O6 HNKDMZBYGADBFP-LOUZIDRQSA-N -HMDB0042380 852.720690811 TG(14:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C55H96O6 ITNUXAAETYEROX-ROWCXXIOSA-N -HMDB0042381 884.783291069 TG(14:0/18:1(9Z)/22:2(13Z,16Z)) C57H104O6 CQKDVCRIDIZFBZ-AILSCRDTSA-N -HMDB0042382 880.75199094 TG(14:0/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C57H100O6 XSDZXQPLCUUMHQ-UVCLIKTKSA-N -HMDB0042386 852.720690811 TG(14:0/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C55H96O6 ZMAGTKGPGZLWKS-AJFURAKFSA-N -HMDB0042395 888.814591198 TG(14:0/20:1(11Z)/20:0) C57H108O6 JOYRTBZPFLTFIB-SEDDCBKKSA-N -HMDB0042396 916.845891326 TG(14:0/20:1(11Z)/22:0) C59H112O6 YSLQGXDXYVVXSS-WOGGMIHASA-N -HMDB0042403 882.767641004 TG(14:0/20:1(11Z)/20:3(5Z,8Z,11Z)) C57H102O6 MSCHPHKYTIAZQI-YRNGPHGYSA-N -HMDB0042404 914.830241262 TG(14:0/20:1(11Z)/22:1(13Z)) C59H110O6 AYBAPOVPJJUOKS-XWDCVAGASA-N -HMDB0042405 942.861541391 TG(14:0/20:1(11Z)/24:1(15Z)) C61H114O6 ZIESYZCKIBNJDP-SUORVOMPSA-N -HMDB0042406 856.75199094 TG(14:0/20:1(11Z)/18:2(9Z,12Z)) C55H100O6 UOGFRTWKEGEEJU-GZAUDGQBSA-N -HMDB0042408 884.783291069 TG(14:0/20:1(11Z)/20:2n6) C57H104O6 BLFWZVXARGMXGK-BSXLTLLISA-N -HMDB0042409 882.767641004 TG(14:0/20:1(11Z)/20:3n6) C57H102O6 PEGBVZIRKWFBAT-JRYSQXLCSA-N -HMDB0042410 880.75199094 TG(14:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C57H100O6 YJIQPDYUKSNQSN-HVVTZQISSA-N -HMDB0042415 852.720690811 TG(14:0/20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C55H96O6 LBUUFNMBIYFPRT-BITRGYHOSA-N -HMDB0042416 880.75199094 TG(14:0/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C57H100O6 JKPSHAYASLXJTD-HOEOXLNCSA-N -HMDB0042424 856.75199094 TG(14:0/20:3(5Z,8Z,11Z)/18:0) C55H100O6 VBYDXPQVGUJUTN-JSMSRUFTSA-N -HMDB0042425 884.783291069 TG(14:0/20:3(5Z,8Z,11Z)/20:0) C57H104O6 RRKINLPZPZCTKA-LMZWPPTNSA-N -HMDB0042427 940.845891326 TG(14:0/20:3(5Z,8Z,11Z)/24:0) C61H112O6 LRUXRFQLJJKABR-NTRBDCRGSA-N -HMDB0042432 882.767641004 TG(14:0/20:3(5Z,8Z,11Z)/20:1(11Z)) C57H102O6 XGUAEFVIYUUGBB-SFLWHIISSA-N -HMDB0042435 938.830241262 TG(14:0/20:3(5Z,8Z,11Z)/24:1(15Z)) C61H110O6 TXWDWSJYGIFVKP-QTUURNJWSA-N -HMDB0042436 852.720690811 TG(14:0/20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C55H96O6 QQWCQYWWJUBCHW-FOFSZCNFSA-N -HMDB0042438 880.75199094 TG(14:0/20:3(5Z,8Z,11Z)/20:2n6) C57H100O6 WKYUVRSDBBUBSZ-FFQUBBCJSA-N -HMDB0042449 900.720690811 TG(14:0/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 LDSWEOUGZDGWFT-JSUZTTPBSA-N -HMDB0042450 842.772726384 TG(14:0/20:3(5Z,8Z,11Z)/o-18:0) C55H102O5 VHTASOICTBAXTL-CEMHFFQRSA-N -HMDB0042454 888.814591198 TG(14:0/22:1(13Z)/18:0) C57H108O6 KTVQVVATLSBTAO-ULQCEOSSSA-N -HMDB0042455 916.845891326 TG(14:0/22:1(13Z)/20:0) C59H112O6 HLUWGRVFRNCPHH-LIZMGIQCSA-N -HMDB0042457 972.908491584 TG(14:0/22:1(13Z)/24:0) C63H120O6 ABGAPQWSCYUSJV-HBFRPXMKSA-N -HMDB0042462 914.830241262 TG(14:0/22:1(13Z)/20:1(11Z)) C59H110O6 GKCAFLCQQIADCE-XWDCVAGASA-N -HMDB0042464 942.861541391 TG(14:0/22:1(13Z)/22:1(13Z)) C61H114O6 UFZBCZHRQDOVGQ-SUORVOMPSA-N -HMDB0042465 970.89284152 TG(14:0/22:1(13Z)/24:1(15Z)) C63H118O6 JOLAYFVNYLLIOH-RFEPONRGSA-N -HMDB0042466 884.783291069 TG(14:0/22:1(13Z)/18:2(9Z,12Z)) C57H104O6 JSFLWCDRHPDCLD-HSDDVKJASA-N -HMDB0042467 882.767641004 TG(14:0/22:1(13Z)/18:3(6Z,9Z,12Z)) C57H102O6 XHMARDUNPRBYKM-QGCRNVCTSA-N -HMDB0042471 940.845891326 TG(14:0/22:1(13Z)/22:2(13Z,16Z)) C61H112O6 FXCUDDKMKYVUSX-VHNKQUBFSA-N -HMDB0042474 882.767641004 TG(14:0/22:1(13Z)/18:3(9Z,12Z,15Z)) C57H102O6 MBGJURGZJWMMPU-IXGFBZFASA-N -HMDB0042475 880.75199094 TG(14:0/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 HPPGYJJKGFAKGA-TWHLFXJFSA-N -HMDB0042480 874.835326642 TG(14:0/22:1(13Z)/o-18:0) C57H110O5 OWDZAXOWKQAOKC-NQFDQYIDSA-N -HMDB0042483 888.814591198 TG(14:0/24:1(15Z)/16:0) C57H108O6 ZALJSAZYHMHSGO-KAESFFBXSA-N -HMDB0042484 916.845891326 TG(14:0/24:1(15Z)/18:0) C59H112O6 QKSXLUQUGVRSFU-LIZMGIQCSA-N -HMDB0042486 972.908491584 TG(14:0/24:1(15Z)/22:0) C63H120O6 PJQSYBAZIMBSRZ-HFGOSKLVSA-N -HMDB0042490 914.830241262 TG(14:0/24:1(15Z)/18:1(11Z)) C59H110O6 OPXVSFLGAKIILH-FRHRWYISSA-N -HMDB0042491 914.830241262 TG(14:0/24:1(15Z)/18:1(9Z)) C59H110O6 VWLZYYAQPNZEAL-XEFQVAJMSA-N -HMDB0042492 942.861541391 TG(14:0/24:1(15Z)/20:1(11Z)) C61H114O6 WZCFDZGLFKVTIF-SUORVOMPSA-N -HMDB0042493 938.830241262 TG(14:0/24:1(15Z)/20:3(5Z,8Z,11Z)) C61H110O6 OWCXZEZUQYFXCK-XAHVMPOMSA-N -HMDB0042494 970.89284152 TG(14:0/24:1(15Z)/22:1(13Z)) C63H118O6 UISYJGKZKOFBCP-RFEPONRGSA-N -HMDB0042498 940.845891326 TG(14:0/24:1(15Z)/20:2n6) C61H112O6 CCKLWBNVDVDCFO-DMEANTDCSA-N -HMDB0042499 938.830241262 TG(14:0/24:1(15Z)/20:3n6) C61H110O6 IGCRUOUEUMSKRE-IVOQZZDCSA-N -HMDB0042501 968.877191455 TG(14:0/24:1(15Z)/22:2(13Z,16Z)) C63H116O6 GKMLPMONLVGROY-SOBCOFBWSA-N -HMDB0042502 964.845891326 TG(14:0/24:1(15Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 HVJIYFSRIYNDPL-ASSRZALHSA-N -HMDB0042503 962.830241262 TG(14:0/24:1(15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 SFMSLZCWXHIABM-JXIULSMESA-N -HMDB0042508 962.830241262 TG(14:0/24:1(15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 FHNSFDXXUNMFHU-YRXPRKIZSA-N -HMDB0042510 902.866626771 TG(14:0/24:1(15Z)/o-18:0) C59H114O5 SXPXBKWZYGAMMR-LDEKSDTBSA-N -HMDB0042517 914.830241262 TG(14:0/18:2(9Z,12Z)/24:0) C59H110O6 AYBGGTUWOJKGTF-VGDHFZSHSA-N -HMDB0042522 856.75199094 TG(14:0/18:2(9Z,12Z)/20:1(11Z)) C55H100O6 DQXQIWIQYYEGLG-GZAUDGQBSA-N -HMDB0042523 852.720690811 TG(14:0/18:2(9Z,12Z)/20:3(5Z,8Z,11Z)) C55H96O6 GZLQQXVVOPFZRE-BHOUWSDHSA-N -HMDB0042524 884.783291069 TG(14:0/18:2(9Z,12Z)/22:1(13Z)) C57H104O6 FUSQLYSSJGPWCI-HSDDVKJASA-N -HMDB0042529 852.720690811 TG(14:0/18:2(9Z,12Z)/20:3n6) C55H96O6 KRVDGBILMBJWGW-QEPIHLJKSA-N -HMDB0042531 882.767641004 TG(14:0/18:2(9Z,12Z)/22:2(13Z,16Z)) C57H102O6 PZHUYFBIXNXBLU-WTNQUSKBSA-N -HMDB0042545 856.75199094 TG(14:0/18:3(6Z,9Z,12Z)/20:0) C55H100O6 XOUODEXYIDULFE-IFLWFWKYSA-N -HMDB0042546 884.783291069 TG(14:0/18:3(6Z,9Z,12Z)/22:0) C57H104O6 IBKTWXVFMTZJMM-VYLKNDNKSA-N -HMDB0042554 882.767641004 TG(14:0/18:3(6Z,9Z,12Z)/22:1(13Z)) C57H102O6 MAFFVOBYYPRXHD-AHAOIXASSA-N -HMDB0042558 852.720690811 TG(14:0/18:3(6Z,9Z,12Z)/20:2n6) C55H96O6 QQZZZCIYMICCKG-GHRAELQXSA-N -HMDB0042561 880.75199094 TG(14:0/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C57H100O6 NQDCMWMLFSAQCX-XDDMZIJKSA-N -HMDB0042576 914.830241262 TG(14:0/20:2n6/22:0) C59H110O6 NKYCZRRSXYVTLB-KIMIJDTCSA-N -HMDB0042577 942.861541391 TG(14:0/20:2n6/24:0) C61H114O6 AREMZVRDXOGTHG-GEHBLPSASA-N -HMDB0042580 856.75199094 TG(14:0/20:2n6/18:1(11Z)) C55H100O6 DZMOOAMBHOJSHY-RFTPNAAMSA-N -HMDB0042581 856.75199094 TG(14:0/20:2n6/18:1(9Z)) C55H100O6 CJNBEPRDDYRSPK-LOUZIDRQSA-N -HMDB0042582 884.783291069 TG(14:0/20:2n6/20:1(11Z)) C57H104O6 IONCGPWOGZERQG-KKCCIVBRSA-N -HMDB0042583 880.75199094 TG(14:0/20:2n6/20:3(5Z,8Z,11Z)) C57H100O6 RNHDCKNXDJJGEF-KYBZSASRSA-N -HMDB0042585 940.845891326 TG(14:0/20:2n6/24:1(15Z)) C61H112O6 LTDLQTORSCMBOQ-DMEANTDCSA-N -HMDB0042587 852.720690811 TG(14:0/20:2n6/18:3(6Z,9Z,12Z)) C55H96O6 OPTZHODNQOBXMO-XAWCRNHYSA-N -HMDB0042588 882.767641004 TG(14:0/20:2n6/20:2n6) C57H102O6 NEUKLKKOFRWHDB-AUCIZUAGSA-N -HMDB0042589 880.75199094 TG(14:0/20:2n6/20:3n6) C57H100O6 PCGADUJICVENFJ-GRKAFUCNSA-N -HMDB0042594 852.720690811 TG(14:0/20:2n6/18:3(9Z,12Z,15Z)) C55H96O6 PDJONFLBKPVTAF-HHYLQHKESA-N -HMDB0042604 856.75199094 TG(14:0/20:3n6/18:0) C55H100O6 MFFDRCAJUNCFIE-XWDYBTQUSA-N -HMDB0042605 884.783291069 TG(14:0/20:3n6/20:0) C57H104O6 DCAWTWWNADPCKX-XVZWXZDOSA-N -HMDB0042607 940.845891326 TG(14:0/20:3n6/24:0) C61H112O6 ZTYPYYDVEYQFSE-QOADHXRNSA-N -HMDB0042612 882.767641004 TG(14:0/20:3n6/20:1(11Z)) C57H102O6 AWANUXSOQBARQI-RPMBQYMOSA-N -HMDB0042615 938.830241262 TG(14:0/20:3n6/24:1(15Z)) C61H110O6 BVDHVRNSAXAACC-ZSGAXPKRSA-N -HMDB0042616 852.720690811 TG(14:0/20:3n6/18:2(9Z,12Z)) C55H96O6 PBZUQKBKTBJPQG-BLIQHNSJSA-N -HMDB0042618 880.75199094 TG(14:0/20:3n6/20:2n6) C57H100O6 YVGVIKRPSGNSQN-PLSBWLDXSA-N -HMDB0042629 900.720690811 TG(14:0/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 ZXPNAJYOBOKITK-QWLDCRFNSA-N -HMDB0042630 842.772726384 TG(14:0/20:3n6/o-18:0) C55H102O5 UUHNNGQNNNMIKK-FQZFNFCTSA-N -HMDB0042635 882.767641004 TG(14:0/20:4(5Z,8Z,11Z,14Z)/20:0) C57H102O6 JSJXBHBZMVKITQ-TXYGIHTPSA-N -HMDB0042637 938.830241262 TG(14:0/20:4(5Z,8Z,11Z,14Z)/24:0) C61H110O6 AFUMMTADLJXJHO-QPAAUHPVSA-N -HMDB0042640 852.720690811 TG(14:0/20:4(5Z,8Z,11Z,14Z)/18:1(11Z)) C55H96O6 ZFYKFVATZUURMJ-JWUGRJQSSA-N -HMDB0042641 852.720690811 TG(14:0/20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) C55H96O6 JLBLEJPPNIHTIQ-JFVSOPFQSA-N -HMDB0042642 880.75199094 TG(14:0/20:4(5Z,8Z,11Z,14Z)/20:1(11Z)) C57H100O6 VCJBIPBUZKHEIQ-ZDCRMNHRSA-N -HMDB0042653 900.720690811 TG(14:0/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 LXHLNESXEDBVQR-UIJKYENNSA-N -HMDB0042658 900.720690811 TG(14:0/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 QKKDPSPGKMHBNY-UHONFDOHSA-N -HMDB0042665 914.830241262 TG(14:0/22:2(13Z,16Z)/20:0) C59H110O6 HSISMYYRVVPXKG-KNAYTQRDSA-N -HMDB0042666 942.861541391 TG(14:0/22:2(13Z,16Z)/22:0) C61H114O6 NTSBQBZSOJXXMZ-GEHBLPSASA-N -HMDB0042667 970.89284152 TG(14:0/22:2(13Z,16Z)/24:0) C63H118O6 NUEDPKJRKOIZSG-PUAIEPDKSA-N -HMDB0042669 856.75199094 TG(14:0/22:2(13Z,16Z)/16:1(9Z)) C55H100O6 LUCYHIOFVUWJDD-QPRILOHKSA-N -HMDB0042670 884.783291069 TG(14:0/22:2(13Z,16Z)/18:1(11Z)) C57H104O6 KRNGXZWFBACZCQ-CGBZTZCNSA-N -HMDB0042671 884.783291069 TG(14:0/22:2(13Z,16Z)/18:1(9Z)) C57H104O6 JCFQRCZDNUSJCL-AILSCRDTSA-N -HMDB0042674 940.845891326 TG(14:0/22:2(13Z,16Z)/22:1(13Z)) C61H112O6 AHYJLIXVIKISHC-DMEANTDCSA-N -HMDB0042675 968.877191455 TG(14:0/22:2(13Z,16Z)/24:1(15Z)) C63H116O6 JWNQPWOMEKFYMA-SOBCOFBWSA-N -HMDB0042676 882.767641004 TG(14:0/22:2(13Z,16Z)/18:2(9Z,12Z)) C57H102O6 BLNIBJNSVRHQPM-WTNQUSKBSA-N -HMDB0042677 880.75199094 TG(14:0/22:2(13Z,16Z)/18:3(6Z,9Z,12Z)) C57H100O6 UOMPQWRFJUXCEB-CEOLQBJHSA-N -HMDB0042681 938.830241262 TG(14:0/22:2(13Z,16Z)/22:2(13Z,16Z)) C61H110O6 CVSGTFIHUMEUGC-LCJHGLGJSA-N -HMDB0042684 880.75199094 TG(14:0/22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C57H100O6 HFEXMJFDPVATAO-WICJBSEGSA-N -HMDB0042694 882.767641004 TG(14:0/22:4(7Z,10Z,13Z,16Z)/18:0) C57H102O6 XIEUJHVLPZAHHA-ZSPFYABHSA-N -HMDB0042696 938.830241262 TG(14:0/22:4(7Z,10Z,13Z,16Z)/22:0) C61H110O6 FCDMPASDBFINOG-DCQMPBFPSA-N -HMDB0042697 966.861541391 TG(14:0/22:4(7Z,10Z,13Z,16Z)/24:0) C63H114O6 MIRRUHDLDQABSJ-VYRAXEJDSA-N -HMDB0042699 852.720690811 TG(14:0/22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) C55H96O6 POWNQYNUJQKIJN-MUYBOSFNSA-N -HMDB0042700 880.75199094 TG(14:0/22:4(7Z,10Z,13Z,16Z)/18:1(11Z)) C57H100O6 LTKZJLJRCVCLBH-WFLHAWLWSA-N -HMDB0042701 880.75199094 TG(14:0/22:4(7Z,10Z,13Z,16Z)/18:1(9Z)) C57H100O6 VIYIIFOXWFOBDE-BVQXJMJWSA-N -HMDB0042705 964.845891326 TG(14:0/22:4(7Z,10Z,13Z,16Z)/24:1(15Z)) C63H112O6 KKWGNAXIJLGZIW-BKULRGTISA-N -HMDB0042717 900.720690811 TG(14:0/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 HYDJVFGMENBDEL-OULLBYPESA-N -HMDB0042720 868.788376449 TG(14:0/22:4(7Z,10Z,13Z,16Z)/o-18:0) C57H104O5 VDEFXUQSUBAFFB-KJBXMZTMSA-N -HMDB0042723 852.720690811 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/16:0) C55H96O6 QPPIYNYVDUYVQL-NYCWUFLLSA-N -HMDB0042724 880.75199094 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:0) C57H100O6 GZIFFSTVTIRNHB-BUVYJIJBSA-N -HMDB0042727 964.845891326 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/24:0) C63H112O6 NKIGKQWLBIPYDK-VQLANULESA-N -HMDB0042735 962.830241262 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/24:1(15Z)) C63H110O6 DJOOHJRCQZSQJS-XWAQJDDJSA-N -HMDB0042740 900.720690811 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 GPYCLFQJCGOBIU-FIDVBXBDSA-N -HMDB0042746 900.720690811 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 VGXAVCFJDOECRR-ZNJYRVKISA-N -HMDB0042749 924.720690811 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 ISVYJGODJAFSSA-IPVSRADUSA-N -HMDB0042750 866.772726384 TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/o-18:0) C57H102O5 AXWUDJVLHVBXKA-FLQSDFAPSA-N -HMDB0042755 856.75199094 TG(14:0/18:3(9Z,12Z,15Z)/20:0) C55H100O6 VHWNCJQPNDUBCY-JHHRBSFXSA-N -HMDB0042756 884.783291069 TG(14:0/18:3(9Z,12Z,15Z)/22:0) C57H104O6 PZGMSWKRVOYKSW-SKOKRVOXSA-N -HMDB0042764 882.767641004 TG(14:0/18:3(9Z,12Z,15Z)/22:1(13Z)) C57H102O6 OXALJAMNRIYLJO-IXGFBZFASA-N -HMDB0042768 852.720690811 TG(14:0/18:3(9Z,12Z,15Z)/20:2n6) C55H96O6 WGTADRBQBBKAGF-HHYLQHKESA-N -HMDB0042771 880.75199094 TG(14:0/18:3(9Z,12Z,15Z)/22:2(13Z,16Z)) C57H100O6 VMUGUHJRAOSIMU-WICJBSEGSA-N -HMDB0042786 882.767641004 TG(14:0/18:4(6Z,9Z,12Z,15Z)/22:0) C57H102O6 ADDMBQHEJRQEPO-XJAZUKOCSA-N -HMDB0042792 852.720690811 TG(14:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z)) C55H96O6 HCFBZCCMOSAJDD-DFAZIVKCSA-N -HMDB0042794 880.75199094 TG(14:0/18:4(6Z,9Z,12Z,15Z)/22:1(13Z)) C57H100O6 XDAZZLONPIHPNZ-AIFIXOPWSA-N -HMDB0042815 882.767641004 TG(14:0/20:4(8Z,11Z,14Z,17Z)/20:0) C57H102O6 KXZVZPPTASOQMG-DRYBMPILSA-N -HMDB0042817 938.830241262 TG(14:0/20:4(8Z,11Z,14Z,17Z)/24:0) C61H110O6 JXLIWOMLOAXJKY-LCFREUINSA-N -HMDB0042820 852.720690811 TG(14:0/20:4(8Z,11Z,14Z,17Z)/18:1(11Z)) C55H96O6 SPKQDEVVANGEJY-BNDMSUNUSA-N -HMDB0042821 852.720690811 TG(14:0/20:4(8Z,11Z,14Z,17Z)/18:1(9Z)) C55H96O6 AQOIZNNITCNBQE-DBTYPVFMSA-N -HMDB0042822 880.75199094 TG(14:0/20:4(8Z,11Z,14Z,17Z)/20:1(11Z)) C57H100O6 KHMBATLVCVBMAU-KEFKMZDZSA-N -HMDB0042833 900.720690811 TG(14:0/20:4(8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 OIAXGMPMFLBWEB-JRLXNBGBSA-N -HMDB0042838 900.720690811 TG(14:0/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 GQNNXOVIYAQPRC-YXDIGCQTSA-N -HMDB0042844 852.720690811 TG(14:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:0) C55H96O6 RKFWDJFGPBNCBJ-WPRFDENESA-N -HMDB0042845 880.75199094 TG(14:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:0) C57H100O6 GBJTZFHEXHJBKU-SDWVEHCDSA-N -HMDB0042862 900.720690811 TG(14:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C59H96O6 RLKDRDNYMSMXGL-JICBQYMXSA-N -HMDB0042870 838.741426256 TG(14:0/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C55H98O5 CTBYABNARYJUOG-PXJWLBIOSA-N -HMDB0042873 852.720690811 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C55H96O6 XDVVZXAIBRKPCM-FVSUUZJRSA-N -HMDB0042874 880.75199094 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:0) C57H100O6 VTZCRGVLPMDWGI-SIQVBALXSA-N -HMDB0042877 964.845891326 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/24:0) C63H112O6 UAZSECASKQJKIA-XUBMUDRRSA-N -HMDB0042885 962.830241262 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/24:1(15Z)) C63H110O6 MFBJAFVRSRFNBT-LQBAZZTJSA-N -HMDB0042890 900.720690811 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 ADFSEZIUBMYLQX-ZSEFFTMLSA-N -HMDB0042896 900.720690811 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 GJQHRPDIWSJRQK-BRSLTISYSA-N -HMDB0042899 924.720690811 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 KRMCNOVCWGWYHP-CMNCQYTJSA-N -HMDB0042900 866.772726384 TG(14:0/22:5(7Z,10Z,13Z,16Z,19Z)/o-18:0) C57H102O5 YGLHPJUQMNWNAS-KDOAUKQCSA-N -HMDB0042907 962.830241262 TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/24:0) C63H110O6 ZFXPLVLFBHYGSN-SENYAZDGSA-N -HMDB0042913 900.720690811 TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C59H96O6 ZYWNYYJHZYDVCC-SRDKIHLBSA-N -HMDB0042919 900.720690811 TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6) C59H96O6 KZROWLZDIGBBIN-PEFZUGBZSA-N -HMDB0042923 924.720690811 TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C61H96O6 NBPKLINXFYFXMU-GILQWAALSA-N -HMDB0042928 924.720690811 TG(14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 NTYQJMMREGDBBU-GJFINYDISA-N -HMDB0042943 842.772726384 TG(14:0/o-18:0/20:3(5Z,8Z,11Z)) C55H102O5 VMJJCASFGIUXQS-CNSUNOORSA-N -HMDB0042944 874.835326642 TG(14:0/o-18:0/22:1(13Z)) C57H110O5 AIBSNIRRVBNNBP-OONHBSBMSA-N -HMDB0042945 902.866626771 TG(14:0/o-18:0/24:1(15Z)) C59H114O5 OHGQZSIZFJHEIP-YONWZPPLSA-N -HMDB0042949 842.772726384 TG(14:0/o-18:0/20:3n6) C55H102O5 STLRCTZSDOQPTC-IHRSHADNSA-N -HMDB0042952 868.788376449 TG(14:0/o-18:0/22:4(7Z,10Z,13Z,16Z)) C57H104O5 FVACYRCSAZRBJC-FOUBHQQHSA-N -HMDB0042953 866.772726384 TG(14:0/o-18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C57H102O5 DHPCZZMWIIRYJJ-JZMVMTFHSA-N -HMDB0042957 838.741426256 TG(14:0/o-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C55H98O5 TZXMSONPXDUMEW-IYIGBQIMSA-N -HMDB0042958 866.772726384 TG(14:0/o-18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C57H102O5 ZAMYFQHKFGFWHM-PWMOXTNPSA-N -HMDB0042960 750.673740612 TG(15:0/14:0/15:0) C47H90O6 MLEFRDDBNGCWLN-UHFFFAOYSA-N -HMDB0043002 888.814591198 TG(15:0/15:0/24:1(15Z)) C57H108O6 SSIXVUQNKRINJM-ZKWOCSCSSA-N -HMDB0043010 852.720690811 TG(15:0/15:0/22:5(4Z,7Z,10Z,13Z,16Z)) C55H96O6 ODOZWZDIECCVSB-FOMYDZIHSA-N -HMDB0043015 852.720690811 TG(15:0/15:0/22:5(7Z,10Z,13Z,16Z,19Z)) C55H96O6 CKJFKCABBRYLMR-ZDKRBGOHSA-N -HMDB0043029 842.736340876 TG(15:0/16:0/20:3(5Z,8Z,11Z)) C54H98O6 PZPSHGGBTBOCBZ-ASYLUKSTSA-N -HMDB0043035 842.736340876 TG(15:0/16:0/20:3n6) C54H98O6 NVBSJAZGISYRIW-GGVKXYRHSA-N -HMDB0043062 842.736340876 TG(15:0/18:0/18:3(6Z,9Z,12Z)) C54H98O6 OGNCECWXMXWFGY-HXWQFKQRSA-N -HMDB0043067 896.783291069 TG(15:0/18:0/22:4(7Z,10Z,13Z,16Z)) C58H104O6 ALOIXMAWZZBRNQ-OTCXAJMESA-N -HMDB0043087 898.798941133 TG(15:0/20:0/20:3(5Z,8Z,11Z)) C58H106O6 FFJZQCAVRAQRGO-DMRFSXROSA-N -HMDB0043093 898.798941133 TG(15:0/20:0/20:3n6) C58H106O6 RSUWZDOHFVTWQP-JMKWLBHTSA-N -HMDB0043094 896.783291069 TG(15:0/20:0/20:4(5Z,8Z,11Z,14Z)) C58H104O6 IMBBOIUUCCVERC-AIOXISEISA-N -HMDB0043100 896.783291069 TG(15:0/20:0/20:4(8Z,11Z,14Z,17Z)) C58H104O6 HGQVGVFOEAHXRO-CNNZGPJESA-N -HMDB0043120 898.798941133 TG(15:0/22:0/18:3(6Z,9Z,12Z)) C58H106O6 IDANUBRXZAZNTQ-UNDCHBHASA-N -HMDB0043127 898.798941133 TG(15:0/22:0/18:3(9Z,12Z,15Z)) C58H106O6 GNXLOCJIEADZDN-UJKDMMPKSA-N -HMDB0043128 896.783291069 TG(15:0/22:0/18:4(6Z,9Z,12Z,15Z)) C58H104O6 USVBQBCNNHETJO-DYBPWUJNSA-N -HMDB0043182 842.736340876 TG(15:0/14:1(9Z)/22:2(13Z,16Z)) C54H98O6 IMVXYPBBFJIVGK-OCCKZLQQSA-N -HMDB0043208 842.736340876 TG(15:0/16:1(9Z)/20:2n6) C54H98O6 NAFMESDUMVNTKX-QJWNQIOASA-N -HMDB0043235 842.736340876 TG(15:0/18:1(11Z)/18:2(9Z,12Z)) C54H98O6 MODDNOQSVMCAIA-GRBBWMSOSA-N -HMDB0043240 898.798941133 TG(15:0/18:1(11Z)/22:2(13Z,16Z)) C58H106O6 PGPUQOBIJOUZAP-HNBAGWGBSA-N -HMDB0043269 898.798941133 TG(15:0/18:1(9Z)/22:2(13Z,16Z)) C58H106O6 SIDLIHCVDJIGBO-WEYDMKCFSA-N -HMDB0043290 896.783291069 TG(15:0/20:1(11Z)/20:3(5Z,8Z,11Z)) C58H104O6 JKFBAJJRYUESID-PZXKTUKHSA-N -HMDB0043295 898.798941133 TG(15:0/20:1(11Z)/20:2n6) C58H106O6 HJFZDYGJDQBLQJ-DBVOMTASSA-N -HMDB0043296 896.783291069 TG(15:0/20:1(11Z)/20:3n6) C58H104O6 QFFKKKUOMXZADH-FSRIMQAUSA-N -HMDB0043309 842.736340876 TG(15:0/20:3(5Z,8Z,11Z)/16:0) C54H98O6 HVMWRSISSYXDSD-MSKBUFCZSA-N -HMDB0043311 898.798941133 TG(15:0/20:3(5Z,8Z,11Z)/20:0) C58H106O6 IHOAMWFZSKNMBJ-YBNKKXLHSA-N -HMDB0043318 896.783291069 TG(15:0/20:3(5Z,8Z,11Z)/20:1(11Z)) C58H104O6 QNFJULRDTQNJGZ-LSMKTWFLSA-N -HMDB0043351 898.798941133 TG(15:0/22:1(13Z)/18:2(9Z,12Z)) C58H106O6 BVUKOOZQIGAWRK-HRIHOIJHSA-N -HMDB0043352 896.783291069 TG(15:0/22:1(13Z)/18:3(6Z,9Z,12Z)) C58H104O6 ZSTISJVJCWGTAZ-ONBIOLBISA-N -HMDB0043359 896.783291069 TG(15:0/22:1(13Z)/18:3(9Z,12Z,15Z)) C58H104O6 UPJQJJOQKCRAID-QIVDIYIPSA-N -HMDB0043366 888.814591188 TG(15:0/24:1(15Z)/15:0) C57H108O6 VSGBEUWASJCUJL-QPLCGJKRSA-N -HMDB0043403 842.736340876 TG(15:0/18:2(9Z,12Z)/18:1(11Z)) C54H98O6 FOTJQCORLIFPLC-GWRXFGGSSA-N -HMDB0043404 842.736340876 TG(15:0/18:2(9Z,12Z)/18:1(9Z)) C54H98O6 QZSQJRGOJCTPHI-SEKHEXFTSA-N -HMDB0043407 898.798941133 TG(15:0/18:2(9Z,12Z)/22:1(13Z)) C58H106O6 WUDWGAJJZFZCER-HRIHOIJHSA-N -HMDB0043414 896.783291069 TG(15:0/18:2(9Z,12Z)/22:2(13Z,16Z)) C58H104O6 MAWNXWUEDRYQEG-WFWVJCKJSA-N -HMDB0043426 842.736340876 TG(15:0/18:3(6Z,9Z,12Z)/18:0) C54H98O6 LBTCQHAIXPLSSD-KTSZMYSWSA-N -HMDB0043428 898.798941133 TG(15:0/18:3(6Z,9Z,12Z)/22:0) C58H106O6 UYEQRCSOCOOKBP-SNGDCZRFSA-N -HMDB0043436 896.783291069 TG(15:0/18:3(6Z,9Z,12Z)/22:1(13Z)) C58H104O6 ZURRHBGBXGLPHI-YQDWTBABSA-N -HMDB0043452 828.75707632 TG(15:0/18:3(6Z,9Z,12Z)/o-18:0) C54H100O5 YJVSUEAKVIVQIZ-ZSZRDWCUSA-N -HMDB0043460 842.736340876 TG(15:0/20:2n6/16:1(9Z)) C54H98O6 CDADMZPLSYSPIH-QJWNQIOASA-N -HMDB0043463 898.798941133 TG(15:0/20:2n6/20:1(11Z)) C58H106O6 RTBRCTDGSUJPRS-WMNZISQMSA-N -HMDB0043469 896.783291069 TG(15:0/20:2n6/20:2n6) C58H104O6 CTYKAHIYZXXTIN-GTFPHAHYSA-N -HMDB0043483 842.736340876 TG(15:0/20:3n6/16:0) C54H98O6 KFJPYNZNXSQRNB-GGVKXYRHSA-N -HMDB0043485 898.798941133 TG(15:0/20:3n6/20:0) C58H106O6 WTMANSPIMTYBGE-ZPCFJENCSA-N -HMDB0043492 896.783291069 TG(15:0/20:3n6/20:1(11Z)) C58H104O6 ZFYAXBKPUHHCJZ-XNUJDKPWSA-N -HMDB0043514 896.783291069 TG(15:0/20:4(5Z,8Z,11Z,14Z)/20:0) C58H104O6 NCHFLBDZSDCXDQ-COKIJVKSSA-N -HMDB0043546 842.736340876 TG(15:0/22:2(13Z,16Z)/14:1(9Z)) C54H98O6 PBXBPMVNZAGNPS-JDYDOGLSSA-N -HMDB0043548 898.798941133 TG(15:0/22:2(13Z,16Z)/18:1(11Z)) C58H106O6 JCXAOTNONHNUHF-HNBAGWGBSA-N -HMDB0043549 898.798941133 TG(15:0/22:2(13Z,16Z)/18:1(9Z)) C58H106O6 UJQAYELTSBRSML-WEYDMKCFSA-N -HMDB0043554 896.783291069 TG(15:0/22:2(13Z,16Z)/18:2(9Z,12Z)) C58H104O6 AJCVSKDDEKJMGM-WFWVJCKJSA-N -HMDB0043571 896.783291069 TG(15:0/22:4(7Z,10Z,13Z,16Z)/18:0) C58H104O6 TVOKYELEYWPQHJ-LMZBEZNESA-N -HMDB0043597 882.804026513 TG(15:0/22:4(7Z,10Z,13Z,16Z)/o-18:0) C58H106O5 IEYUWTSKPUBHDM-VCYUSANISA-N -HMDB0043598 852.720690804 TG(15:0/22:5(4Z,7Z,10Z,13Z,16Z)/15:0) C55H96O6 IQSXRIYKFXKPPU-JOUZTBHRSA-N -HMDB0043629 842.736340876 TG(15:0/18:3(9Z,12Z,15Z)/18:0) C54H98O6 DCEIEGPNDFHINJ-VKXHGUFGSA-N -HMDB0043631 898.798941133 TG(15:0/18:3(9Z,12Z,15Z)/22:0) C58H106O6 RFTLYHXOQWFSCO-UJKDMMPKSA-N -HMDB0043639 896.783291069 TG(15:0/18:3(9Z,12Z,15Z)/22:1(13Z)) C58H104O6 ZOBZWCYJZUYEQA-QIVDIYIPSA-N -HMDB0043655 828.75707632 TG(15:0/18:3(9Z,12Z,15Z)/o-18:0) C54H100O5 BWUZGPYYZXQIFD-XKCLUBGVSA-N -HMDB0043660 896.783291069 TG(15:0/18:4(6Z,9Z,12Z,15Z)/22:0) C58H104O6 LYNIUWOJUCUGNH-QOBGEQKFSA-N -HMDB0043688 896.783291069 TG(15:0/20:4(8Z,11Z,14Z,17Z)/20:0) C58H104O6 KEFNWJKPJBZOJN-MKYMQNDHSA-N -HMDB0043743 852.720690804 TG(15:0/22:5(7Z,10Z,13Z,16Z,19Z)/15:0) C55H96O6 CYCUFSFDDJJTHB-WRNPFNQTSA-N -HMDB0043816 828.75707632 TG(15:0/o-18:0/18:3(6Z,9Z,12Z)) C54H100O5 POAVLZRSJOCQEL-MNYDZQCVSA-N -HMDB0043821 882.804026513 TG(15:0/o-18:0/22:4(7Z,10Z,13Z,16Z)) C58H106O5 OHNOJBCXHSIKCO-CXFUULEXSA-N -HMDB0043823 828.75707632 TG(15:0/o-18:0/18:3(9Z,12Z,15Z)) C54H100O5 CABYGZXBJNUBCV-MRNHURRUSA-N -HMDB0043841 888.814591198 TG(16:0/14:0/24:1(15Z)) C57H108O6 DVRLSVCQXWGXCP-KAESFFBXSA-N -HMDB0043849 852.720690811 TG(16:0/14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C55H96O6 YLDIXESVFMDKJA-YOSTYZLGSA-N -HMDB0043854 852.720690811 TG(16:0/14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C55H96O6 DHISSBAEVLDFEV-FVSUUZJRSA-N -HMDB0043867 842.736340876 TG(16:0/15:0/20:3(5Z,8Z,11Z)) C54H98O6 VYWMIHTWENZSSH-ASYLUKSTSA-N -HMDB0043873 842.736340876 TG(16:0/15:0/20:3n6) C54H98O6 HZWGBWWUMHOOAG-GGVKXYRHSA-N -HMDB0043895 856.75199094 TG(16:0/16:0/20:3(5Z,8Z,11Z)) C55H100O6 YQQLYNBUCCDBQS-CKBMRXNMSA-N -HMDB0043896 888.814591198 TG(16:0/16:0/22:1(13Z)) C57H108O6 FLALCZKVXJDYDG-ZKWOCSCSSA-N -HMDB0043897 916.845891326 TG(16:0/16:0/24:1(15Z)) C59H112O6 LRTMQTBQQUGLKW-DOVQLJDSSA-N -HMDB0043901 856.75199094 TG(16:0/16:0/20:3n6) C55H100O6 QREQPUUUIPJTAA-DLBIATTASA-N -HMDB0043904 882.767641004 TG(16:0/16:0/22:4(7Z,10Z,13Z,16Z)) C57H102O6 MZUGAQXXWDXZIR-OJYXNCBMSA-N -HMDB0043905 880.75199094 TG(16:0/16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C57H100O6 YGANYFGQLLNHPX-IMJOLEMVSA-N -HMDB0043909 852.720690811 TG(16:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C55H96O6 MKRZSXAKFYWUAW-HWCRKSJOSA-N -HMDB0043910 880.75199094 TG(16:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C57H100O6 JKYPCWURBUPJMX-FXKNXVKBSA-N -HMDB0043920 860.783291069 TG(16:0/18:0/18:1(11Z)) C55H104O6 RBJMAKBTUZSIDN-QCSIWSIHSA-N -HMDB0043923 884.783291069 TG(16:0/18:0/20:3(5Z,8Z,11Z)) C57H104O6 CICXNKCKBFXJSH-LZWIKYMTSA-N -HMDB0043924 916.845891326 TG(16:0/18:0/22:1(13Z)) C59H112O6 KJQOITVLKVGNFB-WOGGMIHASA-N -HMDB0043927 856.75199094 TG(16:0/18:0/18:3(6Z,9Z,12Z)) C55H100O6 SHZPWJWHCSZOEX-IKMPBALGSA-N -HMDB0043929 884.783291069 TG(16:0/18:0/20:3n6) C57H104O6 FAWROKQWRPDLOA-OSWQCXTLSA-N -HMDB0043931 914.830241262 TG(16:0/18:0/22:2(13Z,16Z)) C59H110O6 XUNZJZHRHUQSIJ-AFBXCYEQSA-N -HMDB0043934 856.75199094 TG(16:0/18:0/18:3(9Z,12Z,15Z)) C55H100O6 QRLNWUKVSNTXQG-VWMLCLGZSA-N -HMDB0043936 882.767641004 TG(16:0/18:0/20:4(8Z,11Z,14Z,17Z)) C57H102O6 IJMQCAKVFHJJTI-MXMHWBLZSA-N -HMDB0043937 880.75199094 TG(16:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C57H100O6 WGKBXGXZUVULLG-VPMAWHITSA-N -HMDB0043948 888.814591198 TG(16:0/20:0/18:1(11Z)) C57H108O6 CZMAJLBPYUFDNA-AEGUMOJNSA-N -HMDB0043949 888.814591198 TG(16:0/20:0/18:1(9Z)) C57H108O6 JCVFZHFBLDWEFA-IBZYRLJDSA-N -HMDB0043953 972.908491584 TG(16:0/20:0/24:1(15Z)) C63H120O6 KXNZZVRMSWHVPA-HBFRPXMKSA-N -HMDB0043955 884.783291069 TG(16:0/20:0/18:3(6Z,9Z,12Z)) C57H104O6 BHIUUNLDJFUIJS-JWSNKXTBSA-N -HMDB0043956 914.830241262 TG(16:0/20:0/20:2n6) C59H110O6 QHMIFVZMPUXEAH-AFBXCYEQSA-N -HMDB0043959 942.861541391 TG(16:0/20:0/22:2(13Z,16Z)) C61H114O6 ZWYSQWJROGDLIY-KMHMPRQHSA-N -HMDB0043960 938.830241262 TG(16:0/20:0/22:4(7Z,10Z,13Z,16Z)) C61H110O6 LRLYDHNYCOCMPB-SWZVAHJASA-N -HMDB0043962 884.783291069 TG(16:0/20:0/18:3(9Z,12Z,15Z)) C57H104O6 XALHWTWEHSQIBY-ZBQQGBJQSA-N -HMDB0043963 882.767641004 TG(16:0/20:0/18:4(6Z,9Z,12Z,15Z)) C57H102O6 MEUNMCWGMQZVER-ODQDWSBLSA-N -HMDB0043975 888.814591198 TG(16:0/22:0/16:1(9Z)) C57H108O6 VQWFQOJRISNWCH-WTNBXCFCSA-N -HMDB0043976 916.845891326 TG(16:0/22:0/18:1(11Z)) C59H112O6 MGLUNDCYIGYIEO-SKYDHSLNSA-N -HMDB0043977 916.845891326 TG(16:0/22:0/18:1(9Z)) C59H112O6 KVLYQVRJXYJGRU-FAIRWSLRSA-N -HMDB0043979 940.845891326 TG(16:0/22:0/20:3(5Z,8Z,11Z)) C61H112O6 ZKXHCZXVCQJSLC-UGWYLRMGSA-N -HMDB0043980 972.908491584 TG(16:0/22:0/22:1(13Z)) C63H120O6 CTOZRWCYXGCCPP-HBFRPXMKSA-N -HMDB0043982 914.830241262 TG(16:0/22:0/18:2(9Z,12Z)) C59H110O6 DLHLOJATURJKGG-SQWTXUHUSA-N -HMDB0043984 942.861541391 TG(16:0/22:0/20:2n6) C61H114O6 XAOHLQFHAMQDGH-FLJSPLEDSA-N -HMDB0043985 940.845891326 TG(16:0/22:0/20:3n6) C61H112O6 FYFQGQAMTRIKHO-MAMUJQPPSA-N -HMDB0043986 938.830241262 TG(16:0/22:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 KLBXZRONSATXOR-PRBZMCLESA-N -HMDB0043987 970.89284152 TG(16:0/22:0/22:2(13Z,16Z)) C63H118O6 VBRUDSKZQDCRGT-AIPFJYIQSA-N -HMDB0043988 966.861541391 TG(16:0/22:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 RFESPFKKWBRMFJ-QMJUPJGBSA-N -HMDB0043989 964.845891326 TG(16:0/22:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 GQAUQPCQRVYUQF-BSDKHCPSSA-N -HMDB0043992 938.830241262 TG(16:0/22:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 PTUORBCKDRTJCD-QDYXNFAJSA-N -HMDB0043994 964.845891326 TG(16:0/22:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 RGTDFTBQSPVDLT-BILOXPJZSA-N -HMDB0043995 962.830241262 TG(16:0/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 YDUCJNVMKCLMRK-GDIYQKLGSA-N -HMDB0044002 888.814591198 TG(16:0/24:0/14:1(9Z)) C57H108O6 QSQLLDYMTXNRPS-IXHOOSMISA-N -HMDB0044003 916.845891326 TG(16:0/24:0/16:1(9Z)) C59H112O6 YCRUOZPSQCDMCU-BUKBLQRKSA-N -HMDB0044006 972.908491584 TG(16:0/24:0/20:1(11Z)) C63H120O6 MGBYDKAHDISQBC-NVOZVBLZSA-N -HMDB0044007 968.877191455 TG(16:0/24:0/20:3(5Z,8Z,11Z)) C63H116O6 GKUAJCNVJMNRAV-HPCJMVLVSA-N -HMDB0044010 942.861541391 TG(16:0/24:0/18:2(9Z,12Z)) C61H114O6 QWFBYRTVWVIXIZ-FGLIZSHHSA-N -HMDB0044011 940.845891326 TG(16:0/24:0/18:3(6Z,9Z,12Z)) C61H112O6 GIRHPCGBIJZASY-IUHWKNOBSA-N -HMDB0044012 970.89284152 TG(16:0/24:0/20:2n6) C63H118O6 OLEXXKUUZGHGOQ-KOGOAZCMSA-N -HMDB0044013 968.877191455 TG(16:0/24:0/20:3n6) C63H116O6 BDAPQXURZQCHLV-XQBYCCCTSA-N -HMDB0044014 966.861541391 TG(16:0/24:0/20:4(5Z,8Z,11Z,14Z)) C63H114O6 ZFHHHJBRXGVHEW-TUAJXNQRSA-N -HMDB0044018 940.845891326 TG(16:0/24:0/18:3(9Z,12Z,15Z)) C61H112O6 XASLXNYLAYUVLS-KQWNDZRGSA-N -HMDB0044019 938.830241262 TG(16:0/24:0/18:4(6Z,9Z,12Z,15Z)) C61H110O6 LQBZDHKVUKVJGO-NMSHUJNMSA-N -HMDB0044020 966.861541391 TG(16:0/24:0/20:4(8Z,11Z,14Z,17Z)) C63H114O6 SPLSVCLRKCVCTG-DHYBJZJHSA-N -HMDB0044021 964.845891326 TG(16:0/24:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O6 NWYRSEXEDYEEFM-PZDPHOICSA-N -HMDB0044029 888.814591198 TG(16:0/14:1(9Z)/24:0) C57H108O6 GWIFZHMAJCHBBF-JGXNLIRDSA-N -HMDB0044043 856.75199094 TG(16:0/14:1(9Z)/22:2(13Z,16Z)) C55H100O6 RHYGXFNQVVYIJD-AQMPJRPXSA-N -HMDB0044044 852.720690811 TG(16:0/14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C55H96O6 RXJPMHUSUSIBKN-UQIIGITJSA-N -HMDB0044056 888.814591198 TG(16:0/16:1(9Z)/22:0) C57H108O6 AGLSUDWGYKMXMK-XVDGJACESA-N -HMDB0044057 916.845891326 TG(16:0/16:1(9Z)/24:0) C59H112O6 YBDNVPPIUIROLZ-HDIOEILJSA-N -HMDB0044065 914.830241262 TG(16:0/16:1(9Z)/24:1(15Z)) C59H110O6 KSMPHUBCCOCMRE-NSZDUQPRSA-N -HMDB0044068 856.75199094 TG(16:0/16:1(9Z)/20:2n6) C55H100O6 QDDBVRCUCSETRT-DXUJUDPQSA-N -HMDB0044071 884.783291069 TG(16:0/16:1(9Z)/22:2(13Z,16Z)) C57H104O6 GLPSWGYMFAIAQL-GAAFYMMSSA-N -HMDB0044072 880.75199094 TG(16:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C57H100O6 JULWPANCJCTRDN-KFYGFTBTSA-N -HMDB0044076 852.720690811 TG(16:0/16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C55H96O6 PBFPTUPUIISNJT-LALOFDQDSA-N -HMDB0044083 888.814591198 TG(16:0/18:1(11Z)/20:0) C57H108O6 QKCZWZMHMPYOPG-AEGUMOJNSA-N -HMDB0044084 916.845891326 TG(16:0/18:1(11Z)/22:0) C59H112O6 OZXLEWFIONDQJM-SKYDHSLNSA-N -HMDB0044088 858.767641004 TG(16:0/18:1(11Z)/18:1(11Z)) C55H102O6 NJWLXJXDVKOEOP-LJHRAKOHSA-N -HMDB0044089 858.767641004 TG(16:0/18:1(11Z)/18:1(9Z)) C55H102O6 BUBKDTQRUWZQHX-MTHKWQEISA-N -HMDB0044091 882.767641004 TG(16:0/18:1(11Z)/20:3(5Z,8Z,11Z)) C57H102O6 ZTNYZUSKQOHZBE-KPBBTZOZSA-N -HMDB0044092 914.830241262 TG(16:0/18:1(11Z)/22:1(13Z)) C59H110O6 JBTULCCTZFQLPM-JSPVYFJMSA-N -HMDB0044093 942.861541391 TG(16:0/18:1(11Z)/24:1(15Z)) C61H114O6 AMCYMWCKOMILQE-GKJJFOOMSA-N -HMDB0044094 856.75199094 TG(16:0/18:1(11Z)/18:2(9Z,12Z)) C55H100O6 UOSXDBUYARIRPO-XFAWJRLMSA-N -HMDB0044096 884.783291069 TG(16:0/18:1(11Z)/20:2n6) C57H104O6 MLRYMYSXHCUZDL-VXLYYTGTSA-N -HMDB0044097 882.767641004 TG(16:0/18:1(11Z)/20:3n6) C57H102O6 QNLOBUFLPWUYFF-ZYUDEZIXSA-N -HMDB0044098 880.75199094 TG(16:0/18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C57H100O6 WKSLEDJKCJNITP-AHQIBYCWSA-N -HMDB0044103 852.720690811 TG(16:0/18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C55H96O6 BGXYIUSCTPZXJT-MUHGVWIRSA-N -HMDB0044104 880.75199094 TG(16:0/18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C57H100O6 NPZXCVFGWXHFFP-YFMPGKMFSA-N -HMDB0044112 916.845891326 TG(16:0/18:1(9Z)/22:0) C59H112O6 IFLOLSWWIHPMFV-FAIRWSLRSA-N -HMDB0044116 858.767641004 TG(16:0/18:1(9Z)/18:1(11Z)) C55H102O6 QJRAIXUZRUZYSD-SHXCIMIZSA-N -HMDB0044119 882.767641004 TG(16:0/18:1(9Z)/20:3(5Z,8Z,11Z)) C57H102O6 MLDZOBNZLQGSSG-JPODKDQMSA-N -HMDB0044120 914.830241262 TG(16:0/18:1(9Z)/22:1(13Z)) C59H110O6 DSGUAGSLOJNCIC-ZFWLCYAFSA-N -HMDB0044121 942.861541391 TG(16:0/18:1(9Z)/24:1(15Z)) C61H114O6 QBFPWMQTMYVTPZ-YHAQPZLLSA-N -HMDB0044124 884.783291069 TG(16:0/18:1(9Z)/20:2n6) C57H104O6 JQSCFVCYBPEHML-HLYOSYIHSA-N -HMDB0044125 882.767641004 TG(16:0/18:1(9Z)/20:3n6) C57H102O6 XSESJUIKHHMUIV-VOWGSZCXSA-N -HMDB0044131 852.720690811 TG(16:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C55H96O6 WZPQAQGIOSQQKF-XVLKUSPHSA-N -HMDB0044132 880.75199094 TG(16:0/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C57H100O6 WNGNQJVTTOEUDY-DBZJWIPXSA-N -HMDB0044138 888.814591198 TG(16:0/20:1(11Z)/18:0) C57H108O6 QVDYDIZGXSWABG-SEDDCBKKSA-N -HMDB0044139 916.845891326 TG(16:0/20:1(11Z)/20:0) C59H112O6 YWSYMQKEXATFKF-JXHGQNSUSA-N -HMDB0044141 972.908491584 TG(16:0/20:1(11Z)/24:0) C63H120O6 OWXSQMIDLXAPIW-NVOZVBLZSA-N -HMDB0044148 942.861541391 TG(16:0/20:1(11Z)/22:1(13Z)) C61H114O6 KAAHBDXVVGSEAD-QWUUBBNBSA-N -HMDB0044149 970.89284152 TG(16:0/20:1(11Z)/24:1(15Z)) C63H118O6 YADRKXZELPOCPI-UXCFDMNKSA-N -HMDB0044150 884.783291069 TG(16:0/20:1(11Z)/18:2(9Z,12Z)) C57H104O6 XAMNFTPGEKLFFB-ZWFWDJCYSA-N -HMDB0044151 882.767641004 TG(16:0/20:1(11Z)/18:3(6Z,9Z,12Z)) C57H102O6 DACIDRBKCGJUFT-ARHXLKQZSA-N -HMDB0044155 940.845891326 TG(16:0/20:1(11Z)/22:2(13Z,16Z)) C61H112O6 VOQAPCORCIBANS-GBEOITIKSA-N -HMDB0044158 882.767641004 TG(16:0/20:1(11Z)/18:3(9Z,12Z,15Z)) C57H102O6 PZLANHYIZMKDPR-KKELCOOUSA-N -HMDB0044159 880.75199094 TG(16:0/20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 DFOGLEBUXTZMDU-MDCWYYKHSA-N -HMDB0044164 874.835326642 TG(16:0/20:1(11Z)/o-18:0) C57H110O5 COSWJIZWAODXNP-DGWQIHMPSA-N -HMDB0044165 856.751990932 TG(16:0/20:3(5Z,8Z,11Z)/16:0) C55H100O6 WQVLEJVLEGNDEG-SHFOZATNSA-N -HMDB0044166 884.783291069 TG(16:0/20:3(5Z,8Z,11Z)/18:0) C57H104O6 LTJDBKBPSJHJDU-NGKPHMPMSA-N -HMDB0044168 940.845891326 TG(16:0/20:3(5Z,8Z,11Z)/22:0) C61H112O6 XYIPDNMNPDTONZ-FIMOYKNJSA-N -HMDB0044169 968.877191455 TG(16:0/20:3(5Z,8Z,11Z)/24:0) C63H116O6 UJMUINYNSNMHQZ-WXECGWRZSA-N -HMDB0044172 882.767641004 TG(16:0/20:3(5Z,8Z,11Z)/18:1(11Z)) C57H102O6 MLAOSVRSJAVRAU-BTWJNDKWSA-N -HMDB0044173 882.767641004 TG(16:0/20:3(5Z,8Z,11Z)/18:1(9Z)) C57H102O6 KUYUHOFPMWBZLG-LIZDPAILSA-N -HMDB0044176 938.830241262 TG(16:0/20:3(5Z,8Z,11Z)/22:1(13Z)) C61H110O6 FEPAFMXZJSAXNQ-WEHGMCGESA-N -HMDB0044177 966.861541391 TG(16:0/20:3(5Z,8Z,11Z)/24:1(15Z)) C63H114O6 UDLIAKHQDWRPKP-NNSHHAFBSA-N -HMDB0044178 880.75199094 TG(16:0/20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C57H100O6 JDYQORQUIVEAPP-NYXGXXPCSA-N -HMDB0044192 870.804026513 TG(16:0/20:3(5Z,8Z,11Z)/o-18:0) C57H106O5 YJWYQQFOJUDNJP-HLXYMFJYSA-N -HMDB0044193 888.814591188 TG(16:0/22:1(13Z)/16:0) C57H108O6 AODXXMPHCMURJU-QPLCGJKRSA-N -HMDB0044194 916.845891326 TG(16:0/22:1(13Z)/18:0) C59H112O6 LOEVQQYBQLFELJ-WOGGMIHASA-N -HMDB0044196 972.908491584 TG(16:0/22:1(13Z)/22:0) C63H120O6 ANOUVNADVQFHPD-NVOZVBLZSA-N -HMDB0044200 914.830241262 TG(16:0/22:1(13Z)/18:1(11Z)) C59H110O6 UBCKVROCLDZVDL-JSPVYFJMSA-N -HMDB0044201 914.830241262 TG(16:0/22:1(13Z)/18:1(9Z)) C59H110O6 XFLBIJMMCSCPBO-ZFWLCYAFSA-N -HMDB0044202 942.861541391 TG(16:0/22:1(13Z)/20:1(11Z)) C61H114O6 XWHMTYPOWZWZQD-QWUUBBNBSA-N -HMDB0044203 938.830241262 TG(16:0/22:1(13Z)/20:3(5Z,8Z,11Z)) C61H110O6 SMBSCRUSQBQPKE-CJUHTPNFSA-N -HMDB0044204 970.89284152 TG(16:0/22:1(13Z)/22:1(13Z)) C63H118O6 QVXASAXDWWFXGC-UXCFDMNKSA-N -HMDB0044208 940.845891326 TG(16:0/22:1(13Z)/20:2n6) C61H112O6 XNXYVFSTYMBATM-GDBNEEMHSA-N -HMDB0044209 938.830241262 TG(16:0/22:1(13Z)/20:3n6) C61H110O6 ZHTYGSYTHOBYHT-YMNXCIPXSA-N -HMDB0044211 968.877191455 TG(16:0/22:1(13Z)/22:2(13Z,16Z)) C63H116O6 HCEFBTFVOASXGI-FDOWAUNPSA-N -HMDB0044212 964.845891326 TG(16:0/22:1(13Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 MZNKMPMMJCRJCG-PNYXPBEMSA-N -HMDB0044213 962.830241262 TG(16:0/22:1(13Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 ANGPTMIQAOFQBH-FHUKAYIXSA-N -HMDB0044218 962.830241262 TG(16:0/22:1(13Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 WWQOCPZHIQRZNO-BHRWDTBDSA-N -HMDB0044220 902.866626771 TG(16:0/22:1(13Z)/o-18:0) C59H114O5 RJHUVVVYTCGXGM-AZOUTRKJSA-N -HMDB0044221 916.845891316 TG(16:0/24:1(15Z)/16:0) C59H112O6 QZSWQEQRBHPEOS-QPLCGJKRSA-N -HMDB0044223 972.908491584 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-HMDB0044465 954.767641004 TG(16:0/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 SGSCBPFVSOCVPP-DRUNYDBDSA-N -HMDB0044467 900.720690811 TG(16:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 STSSOOUAZVGHGT-LCNRRWAFSA-N -HMDB0044470 954.767641004 TG(16:0/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 HSNGDBNPPHCXGS-MUCARDSESA-N -HMDB0044471 952.75199094 TG(16:0/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 NDNNXIWBJOKRCM-WVVFJPSCSA-N -HMDB0044474 856.75199094 TG(16:0/18:3(9Z,12Z,15Z)/18:0) C55H100O6 KKBIJNWSACWOQA-MRNHURRUSA-N -HMDB0044475 884.783291069 TG(16:0/18:3(9Z,12Z,15Z)/20:0) C57H104O6 QMOIIDCAFLCLKL-ZBQQGBJQSA-N -HMDB0044477 940.845891326 TG(16:0/18:3(9Z,12Z,15Z)/24:0) C61H112O6 UZJFJKLCXWYRPN-KQWNDZRGSA-N -HMDB0044482 882.767641004 TG(16:0/18:3(9Z,12Z,15Z)/20:1(11Z)) C57H102O6 PDTAQKYFJJGDCD-KKELCOOUSA-N -HMDB0044485 938.830241262 TG(16:0/18:3(9Z,12Z,15Z)/24:1(15Z)) C61H110O6 JLNYLODKIXIHKZ-KEEBEWHXSA-N -HMDB0044486 852.720690811 TG(16:0/18:3(9Z,12Z,15Z)/18:2(9Z,12Z)) C55H96O6 DZXZWZCELPDEAY-GYJCYCAFSA-N -HMDB0044488 880.75199094 TG(16:0/18:3(9Z,12Z,15Z)/20:2n6) C57H100O6 QUFRRPUAEDKDEW-CGEWGDRRSA-N -HMDB0044499 900.720690811 TG(16:0/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 AWKZRMLSPPFBRT-GOKSIDPXSA-N -HMDB0044500 842.772726384 TG(16:0/18:3(9Z,12Z,15Z)/o-18:0) C55H102O5 OAJGGPOBXCODBI-BBGBDTNPSA-N -HMDB0044503 882.767641004 TG(16:0/18:4(6Z,9Z,12Z,15Z)/20:0) C57H102O6 PDFFYHNLAKMFAW-DBLJNIQDSA-N -HMDB0044505 938.830241262 TG(16:0/18:4(6Z,9Z,12Z,15Z)/24:0) C61H110O6 JRPWNZDPXIIZOM-LPKUTSTHSA-N -HMDB0044508 852.720690811 TG(16:0/18:4(6Z,9Z,12Z,15Z)/18:1(11Z)) C55H96O6 RCIYSTQFXHSCKA-MPJXLQPGSA-N -HMDB0044509 852.720690811 TG(16:0/18:4(6Z,9Z,12Z,15Z)/18:1(9Z)) C55H96O6 NGEHHICSKHOVLR-NFDSFMNFSA-N -HMDB0044510 880.75199094 TG(16:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z)) C57H100O6 VWRXQZKIYNYMGG-ZGFNYXQRSA-N -HMDB0044521 900.720690811 TG(16:0/18:4(6Z,9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 ZLDJFFNRXQCWDI-NEYNGORJSA-N -HMDB0044526 900.720690811 TG(16:0/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 NPDNCNMIHPPXLG-NEWSEWFISA-N -HMDB0044530 882.767641004 TG(16:0/20:4(8Z,11Z,14Z,17Z)/18:0) C57H102O6 OEXKOFIGSYEMIC-NRHFPUSWSA-N -HMDB0044532 938.830241262 TG(16:0/20:4(8Z,11Z,14Z,17Z)/22:0) C61H110O6 NPGQULUAPOPHIW-OCTKYVPGSA-N -HMDB0044533 966.861541391 TG(16:0/20:4(8Z,11Z,14Z,17Z)/24:0) C63H114O6 MEUKCWGKFGAXPK-DUHQLXHESA-N -HMDB0044535 852.720690811 TG(16:0/20:4(8Z,11Z,14Z,17Z)/16:1(9Z)) C55H96O6 UVTYOGUMIJDHCL-UIMLNZSVSA-N -HMDB0044536 880.75199094 TG(16:0/20:4(8Z,11Z,14Z,17Z)/18:1(11Z)) C57H100O6 MTMROZADXJWIBV-DOECFCCQSA-N -HMDB0044537 880.75199094 TG(16:0/20:4(8Z,11Z,14Z,17Z)/18:1(9Z)) C57H100O6 NGPGSHBLLYRGNQ-MPZPZLFDSA-N -HMDB0044541 964.845891326 TG(16:0/20:4(8Z,11Z,14Z,17Z)/24:1(15Z)) C63H112O6 FYMHLHDVPWTCCO-JYFCDIOCSA-N -HMDB0044553 900.720690811 TG(16:0/20:4(8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 PHOOIXVIRZQNMT-ODAQHYAVSA-N -HMDB0044556 868.788376449 TG(16:0/20:4(8Z,11Z,14Z,17Z)/o-18:0) C57H104O5 ZDQSYJNEPMDFCF-ITQLONQQSA-N -HMDB0044557 852.720690804 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/16:0) C55H96O6 CCKKDORBDQDVMQ-PDZACQBISA-N -HMDB0044558 880.75199094 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:0) C57H100O6 QGFXXHQHYVJYSH-MDZJAPHLSA-N -HMDB0044561 964.845891326 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/24:0) C63H112O6 XNRMSBDDILQLRG-LSKMVMMXSA-N -HMDB0044569 962.830241262 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/24:1(15Z)) C63H110O6 OQTQYHCFGCOUPR-QBUFOSDJSA-N -HMDB0044574 900.720690811 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 ZLPGNDHRJUFQTK-YAGXGABHSA-N -HMDB0044580 900.720690811 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 SHBKQHGKLWWKQN-FBVZUFOSSA-N -HMDB0044583 924.720690811 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 UZFNMPJCAIVEGV-FUXJGXGNSA-N -HMDB0044584 866.772726384 TG(16:0/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C57H102O5 VMKQCJKDAJJLNO-SIDHVLSASA-N -HMDB0044585 880.751990932 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C57H100O6 LEXKCMGVSOPGQN-VNQLBUIQSA-N -HMDB0044588 964.845891326 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:0) C63H112O6 YQESTRXWSPZNHW-WKPJWWPASA-N -HMDB0044596 962.830241262 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:1(13Z)) C63H110O6 DTGWBWNZTSFJEB-QSAUUDRYSA-N -HMDB0044604 956.783291069 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 UEPGRXMBZHCOGK-NSRUUUQVSA-N -HMDB0044605 954.767641004 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 SJRLCZGQDXBYGK-HKWNKZEVSA-N -HMDB0044607 900.720690811 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 VVTVYFURJIUZNX-IZEDADKKSA-N -HMDB0044610 954.767641004 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 XMRBIWWWAIEADV-MIDLRVRISA-N -HMDB0044611 952.75199094 TG(16:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 QVOHTEKWCOOZBV-FIJPMMNYSA-N -HMDB0044616 962.830241262 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:0) C63H110O6 PTSDZIVZWSSOQV-PYNBEOIPSA-N -HMDB0044627 900.720690811 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(6Z,9Z,12Z)) C59H96O6 IXNKUAVBSAJEIR-MCQMTRFLSA-N -HMDB0044631 958.798941133 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)) C63H106O6 RKCXETNTKLONSQ-MAIVSZGYSA-N -HMDB0044632 954.767641004 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 BKNNALCUTFKXQS-PGTFXPQGSA-N -HMDB0044633 952.75199094 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 LSBAYMYULGHGQO-YFBBKOKWSA-N -HMDB0044634 900.720690811 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C59H96O6 BZUMTISSRAZIGC-WUXINBHBSA-N -HMDB0044637 924.720690811 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 FPEZLWDATYZAAB-IFVHAZKQSA-N -HMDB0044638 952.75199094 TG(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 LVRSHDOEDJOBJJ-DSSMBJFESA-N -HMDB0044648 846.804026513 TG(16:0/o-18:0/18:1(11Z)) C55H106O5 HTFZBWPHGZEFJU-SEXWVFGWSA-N -HMDB0044649 846.804026513 TG(16:0/o-18:0/18:1(9Z)) C55H106O5 JPBYHVQUOOKCGQ-ZNYBSJEJSA-N -HMDB0044650 874.835326642 TG(16:0/o-18:0/20:1(11Z)) C57H110O5 XTQUNVXMTVIEJG-AFHCKBSLSA-N -HMDB0044651 870.804026513 TG(16:0/o-18:0/20:3(5Z,8Z,11Z)) C57H106O5 LLMPANOXXMGKRF-XLRYZWMHSA-N -HMDB0044652 902.866626771 TG(16:0/o-18:0/22:1(13Z)) C59H114O5 SXBWOXCOXHTAAM-QWQBRNDCSA-N -HMDB0044655 842.772726384 TG(16:0/o-18:0/18:3(6Z,9Z,12Z)) C55H102O5 FBJIMBUHNICHHH-SNPAGUQISA-N -HMDB0044657 870.804026513 TG(16:0/o-18:0/20:3n6) C57H106O5 QYHOZSHVNKWJLV-FOVPWYMNSA-N -HMDB0044658 868.788376449 TG(16:0/o-18:0/20:4(5Z,8Z,11Z,14Z)) C57H104O5 XGUVLROHLQCRKO-ZJVHBQSJSA-N -HMDB0044659 900.850976706 TG(16:0/o-18:0/22:2(13Z,16Z)) C59H112O5 RUVUJZWBOUFWTN-UVWMBFROSA-N -HMDB0044662 842.772726384 TG(16:0/o-18:0/18:3(9Z,12Z,15Z)) C55H102O5 IAFYDEPWYHOLIH-LEHRLSSESA-N -HMDB0044664 868.788376449 TG(16:0/o-18:0/20:4(8Z,11Z,14Z,17Z)) C57H104O5 LKASLILCGPZWOF-IITLLJDESA-N -HMDB0044665 866.772726384 TG(16:0/o-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C57H102O5 PQQIAQSGMRDMKV-JQJNNHAYSA-N -HMDB0044677 856.75199094 TG(18:0/14:0/20:3(5Z,8Z,11Z)) C55H100O6 RHVDDKIIECRCMU-DLKASECUSA-N -HMDB0044678 888.814591198 TG(18:0/14:0/22:1(13Z)) C57H108O6 CQDCLPYZVBWAGY-ULQCEOSSSA-N -HMDB0044679 916.845891326 TG(18:0/14:0/24:1(15Z)) C59H112O6 PDFSKQVPIUDFLH-LIZMGIQCSA-N -HMDB0044683 856.75199094 TG(18:0/14:0/20:3n6) C55H100O6 PODGNDQRHPDVSY-XWDYBTQUSA-N -HMDB0044686 882.767641004 TG(18:0/14:0/22:4(7Z,10Z,13Z,16Z)) C57H102O6 KMUBMOMDOAVSGD-ZSPFYABHSA-N -HMDB0044687 880.75199094 TG(18:0/14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C57H100O6 ZNJHBXLEVATVCP-LTEQPIAUSA-N -HMDB0044691 852.720690811 TG(18:0/14:0/20:5(5Z,8Z,11Z,14Z,17Z)) C55H96O6 GGCGDJPSQJXGBG-FTQYIZGESA-N -HMDB0044692 880.75199094 TG(18:0/14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C57H100O6 ZSFGHQACWUKLCX-SIQVBALXSA-N -HMDB0044708 842.736340876 TG(18:0/15:0/18:3(6Z,9Z,12Z)) C54H98O6 SAZSVOQHSUNCSC-JADYITACSA-N -HMDB0044713 896.783291069 TG(18:0/15:0/22:4(7Z,10Z,13Z,16Z)) C58H104O6 ZMDXJSHVNGLQDM-LMZBEZNESA-N -HMDB0044715 842.736340876 TG(18:0/15:0/18:3(9Z,12Z,15Z)) C54H98O6 XBEBXEQYPIBWCY-ZCTUBHHNSA-N -HMDB0044730 888.814591198 TG(18:0/16:0/20:1(11Z)) C57H108O6 ZKAJTUDTPFXDPB-SEDDCBKKSA-N -HMDB0044731 884.783291069 TG(18:0/16:0/20:3(5Z,8Z,11Z)) C57H104O6 MIAZWSJURHHRMR-GEHCCJHRSA-N -HMDB0044732 916.845891326 TG(18:0/16:0/22:1(13Z)) C59H112O6 AFMQYZXPYJFAPA-WOGGMIHASA-N -HMDB0044735 856.75199094 TG(18:0/16:0/18:3(6Z,9Z,12Z)) C55H100O6 HFPMGYAXBUYRKI-UEZFUHSISA-N -HMDB0044737 884.783291069 TG(18:0/16:0/20:3n6) C57H104O6 JKGVPFAPBARTLP-YQUMZMGISA-N -HMDB0044738 882.767641004 TG(18:0/16:0/20:4(5Z,8Z,11Z,14Z)) C57H102O6 PJEBJEMINBSXRV-KEUVTSRESA-N -HMDB0044739 914.830241262 TG(18:0/16:0/22:2(13Z,16Z)) C59H110O6 YCBZYOWJNQIJSW-AFBXCYEQSA-N -HMDB0044744 882.767641004 TG(18:0/16:0/20:4(8Z,11Z,14Z,17Z)) C57H102O6 PTRBUWWBGNLWCI-NRHFPUSWSA-N -HMDB0044745 880.75199094 TG(18:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C57H100O6 JVXNBCRQHASIJK-SLVIZCAPSA-N -HMDB0044760 972.908491584 TG(18:0/18:0/24:1(15Z)) C63H120O6 RMGUQZSFJCIQCW-HZLQDPIMSA-N -HMDB0044762 884.783291069 TG(18:0/18:0/18:3(6Z,9Z,12Z)) C57H104O6 KQKXUUFGXDXTLP-QOHXHYQGSA-N -HMDB0044763 914.830241262 TG(18:0/18:0/20:2n6) C59H110O6 VJGBLJQPGREUIJ-HTEIQMDFSA-N -HMDB0044766 942.861541391 TG(18:0/18:0/22:2(13Z,16Z)) C61H114O6 KJRBHONTDZUSAV-UAHPIIFWSA-N -HMDB0044767 938.830241262 TG(18:0/18:0/22:4(7Z,10Z,13Z,16Z)) C61H110O6 AHTWTNHQUCGAHA-PPSYREMASA-N -HMDB0044769 884.783291069 TG(18:0/18:0/18:3(9Z,12Z,15Z)) C57H104O6 UFGXGACWXCNPJD-DYJODZIASA-N -HMDB0044770 882.767641004 TG(18:0/18:0/18:4(6Z,9Z,12Z,15Z)) C57H102O6 QDQDETHJEUGTEX-DBKGETMJSA-N -HMDB0044781 888.814591198 TG(18:0/20:0/16:1(9Z)) C57H108O6 DATRBAYWFQZJEM-YWGGJCCTSA-N -HMDB0044782 916.845891326 TG(18:0/20:0/18:1(11Z)) C59H112O6 GZBPQMRKEPSOQQ-BUKBLQRKSA-N -HMDB0044783 916.845891326 TG(18:0/20:0/18:1(9Z)) C59H112O6 PMGLNPPJDNWBFI-KMWQWKMBSA-N -HMDB0044785 940.845891326 TG(18:0/20:0/20:3(5Z,8Z,11Z)) C61H112O6 IMVQRDFIBOZOMA-UGTFNXFHSA-N -HMDB0044786 972.908491584 TG(18:0/20:0/22:1(13Z)) C63H120O6 APCPZQYJQIVCIQ-HZLQDPIMSA-N -HMDB0044788 914.830241262 TG(18:0/20:0/18:2(9Z,12Z)) C59H110O6 XVCFHZCPVLNAMA-BSPWMJLXSA-N -HMDB0044790 942.861541391 TG(18:0/20:0/20:2n6) C61H114O6 PFPODELEONWMHD-UAHPIIFWSA-N -HMDB0044791 940.845891326 TG(18:0/20:0/20:3n6) C61H112O6 ATLSKDGFHXWZQX-LBLMAAEJSA-N -HMDB0044793 970.89284152 TG(18:0/20:0/22:2(13Z,16Z)) C63H118O6 HFPSXYRYGSJWEL-NUXSQISZSA-N -HMDB0044794 966.861541391 TG(18:0/20:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 WRPAVJZVCFOMOP-ZKHXJDFVSA-N -HMDB0044795 964.845891326 TG(18:0/20:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 QCIAAKBWAXWFOI-AZQLJNOYSA-N -HMDB0044798 938.830241262 TG(18:0/20:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 PBWSYTBHNXUZPG-LRCNZTLDSA-N -HMDB0044800 964.845891326 TG(18:0/20:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 IPHODDSCNVBUSO-SHMLEVFJSA-N -HMDB0044801 962.830241262 TG(18:0/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 NDODQCHGZSBDMO-AKZASNDYSA-N -HMDB0044807 888.814591198 TG(18:0/22:0/14:1(9Z)) C57H108O6 HMQDPLNLSJNOFZ-IXHOOSMISA-N -HMDB0044808 916.845891326 TG(18:0/22:0/16:1(9Z)) C59H112O6 RXFCPNVEKZDTFB-SZPKOVDMSA-N -HMDB0044811 972.908491584 TG(18:0/22:0/20:1(11Z)) C63H120O6 UMQZVBBPQUGNIW-WNYHZXHYSA-N -HMDB0044812 968.877191455 TG(18:0/22:0/20:3(5Z,8Z,11Z)) C63H116O6 BNEOBBHFUOWGMG-WZMHKBLQSA-N -HMDB0044815 942.861541391 TG(18:0/22:0/18:2(9Z,12Z)) C61H114O6 VBCHYGJCHLNVFC-VSQDVKCVSA-N -HMDB0044816 940.845891326 TG(18:0/22:0/18:3(6Z,9Z,12Z)) C61H112O6 VXILKXGVHSBSGJ-VNYALLQPSA-N -HMDB0044817 970.89284152 TG(18:0/22:0/20:2n6) C63H118O6 MIWJGWAISDNXBZ-ZTVVXRKDSA-N -HMDB0044818 968.877191455 TG(18:0/22:0/20:3n6) C63H116O6 JQOSLGXBJPERKJ-SVZCIJRBSA-N -HMDB0044819 966.861541391 TG(18:0/22:0/20:4(5Z,8Z,11Z,14Z)) C63H114O6 TVQFPEHRCSMMRD-HGWIOKADSA-N -HMDB0044823 940.845891326 TG(18:0/22:0/18:3(9Z,12Z,15Z)) C61H112O6 MFNWYZFORRXQHT-HGUYPXMVSA-N -HMDB0044824 938.830241262 TG(18:0/22:0/18:4(6Z,9Z,12Z,15Z)) C61H110O6 KDCWAZIMGWULJP-RMFNYSRHSA-N -HMDB0044825 966.861541391 TG(18:0/22:0/20:4(8Z,11Z,14Z,17Z)) C63H114O6 OLGCAYHSBQAASU-DJOUEDBJSA-N -HMDB0044826 964.845891326 TG(18:0/22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O6 PFQZTTBUBNIVPK-ORUCCLEHSA-N -HMDB0044834 916.845891326 TG(18:0/24:0/14:1(9Z)) C59H112O6 UUZMFQOOGKVJDO-AAABZKSKSA-N -HMDB0044836 972.908491584 TG(18:0/24:0/18:1(11Z)) C63H120O6 RUXLBRZLBVLBFV-SVFUARKBSA-N -HMDB0044837 972.908491584 TG(18:0/24:0/18:1(9Z)) C63H120O6 CRRULBZKNVQXFP-LTLOUOCESA-N -HMDB0044842 970.89284152 TG(18:0/24:0/18:2(9Z,12Z)) C63H118O6 WVBWJULBZBNZMZ-WFYVVMRGSA-N -HMDB0044843 968.877191455 TG(18:0/24:0/18:3(6Z,9Z,12Z)) C63H116O6 KOGFJPQTJBKODN-LRSIYDEUSA-N -HMDB0044850 968.877191455 TG(18:0/24:0/18:3(9Z,12Z,15Z)) C63H116O6 BJGXENBEKNJTIW-UDMQSNSMSA-N -HMDB0044851 966.861541391 TG(18:0/24:0/18:4(6Z,9Z,12Z,15Z)) C63H114O6 VGHLSLRDNJIASC-BVKAFERTSA-N -HMDB0044859 888.814591198 TG(18:0/14:1(9Z)/22:0) C57H108O6 CLQGNDGHULBBGK-JGXNLIRDSA-N -HMDB0044860 916.845891326 TG(18:0/14:1(9Z)/24:0) C59H112O6 SKXGGXXHUILISA-YCJNRUSJSA-N -HMDB0044868 914.830241262 TG(18:0/14:1(9Z)/24:1(15Z)) C59H110O6 RWXPDMYGJSOHGX-AZKDRWSUSA-N -HMDB0044871 856.75199094 TG(18:0/14:1(9Z)/20:2n6) C55H100O6 JPOLYQGYZVQSPO-LPLBOQDCSA-N -HMDB0044873 852.720690811 TG(18:0/14:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C55H96O6 QXJSFSDQSFDVAT-UYLMMYTRSA-N -HMDB0044874 884.783291069 TG(18:0/14:1(9Z)/22:2(13Z,16Z)) C57H104O6 HFLPEQAAOJSPGG-YXBKKIBYSA-N -HMDB0044875 880.75199094 TG(18:0/14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C57H100O6 AQMKAYODMONDGF-UVCNXRMISA-N -HMDB0044879 852.720690811 TG(18:0/14:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C55H96O6 GEPOGMMCAWOWOH-OBWKOLQCSA-N -HMDB0044885 888.814591198 TG(18:0/16:1(9Z)/20:0) C57H108O6 SCRUPIUQFHRDIJ-XVDGJACESA-N -HMDB0044886 916.845891326 TG(18:0/16:1(9Z)/22:0) C59H112O6 UTNNVFMIFYLBOY-HDIOEILJSA-N -HMDB0044893 882.767641004 TG(18:0/16:1(9Z)/20:3(5Z,8Z,11Z)) C57H102O6 CVHMEZFGALFXMT-LALVRRJTSA-N -HMDB0044894 914.830241262 TG(18:0/16:1(9Z)/22:1(13Z)) C59H110O6 SWUDGTDLMRDUKM-VFBDGFDBSA-N -HMDB0044895 942.861541391 TG(18:0/16:1(9Z)/24:1(15Z)) C61H114O6 AKJAVHDSGYNHSB-RHKJSXQCSA-N -HMDB0044896 856.75199094 TG(18:0/16:1(9Z)/18:2(9Z,12Z)) C55H100O6 YBYJHYPJVAOSBP-CYRKDGISSA-N -HMDB0044898 884.783291069 TG(18:0/16:1(9Z)/20:2n6) C57H104O6 IDMJDWJMYCKJQJ-XXQKTQNQSA-N -HMDB0044899 882.767641004 TG(18:0/16:1(9Z)/20:3n6) C57H102O6 UTAXARKBUGEENK-BXRAGAEDSA-N -HMDB0044900 880.75199094 TG(18:0/16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C57H100O6 ZXPZKPTYTWDDTR-UKVSDVJNSA-N -HMDB0044905 852.720690811 TG(18:0/16:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C55H96O6 RQYFNWIONOQUSC-OKADOCKFSA-N -HMDB0044906 880.75199094 TG(18:0/16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C57H100O6 LHXURPBLCDMSQT-GQQFAOFJSA-N -HMDB0044911 888.814591188 TG(18:0/18:1(11Z)/18:0) C57H108O6 WVIOMIGIVJHZTN-FLFQWRMESA-N -HMDB0044912 916.845891326 TG(18:0/18:1(11Z)/20:0) C59H112O6 LXPJIWPRELJYCD-HDIOEILJSA-N -HMDB0044914 972.908491584 TG(18:0/18:1(11Z)/24:0) C63H120O6 OSVPTBUSNXGUED-VZKFWILHSA-N -HMDB0044919 914.830241262 TG(18:0/18:1(11Z)/20:1(11Z)) C59H110O6 DRXKVDMYIYMLIN-LEWBGJHJSA-N -HMDB0044921 942.861541391 TG(18:0/18:1(11Z)/22:1(13Z)) C61H114O6 ZLQMLOOMSZNYRJ-XURCBCPLSA-N -HMDB0044922 970.89284152 TG(18:0/18:1(11Z)/24:1(15Z)) C63H118O6 ALEWSTMZONDAQL-WCGXTGDWSA-N -HMDB0044923 884.783291069 TG(18:0/18:1(11Z)/18:2(9Z,12Z)) C57H104O6 TVLMJMFKNWRCGI-HIAAHSCQSA-N -HMDB0044924 882.767641004 TG(18:0/18:1(11Z)/18:3(6Z,9Z,12Z)) C57H102O6 XZEHHPQAMMWALZ-IVXHMXKMSA-N -HMDB0044928 940.845891326 TG(18:0/18:1(11Z)/22:2(13Z,16Z)) C61H112O6 OZLAHDGOWLSOAJ-OEMAFOEQSA-N -HMDB0044931 882.767641004 TG(18:0/18:1(11Z)/18:3(9Z,12Z,15Z)) C57H102O6 QWODFTFSLHKZKF-OKWLNNLGSA-N -HMDB0044932 880.75199094 TG(18:0/18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 AHASBULBODWAPU-CUIPNJCHSA-N -HMDB0044937 874.835326642 TG(18:0/18:1(11Z)/o-18:0) C57H110O5 NTZYNUIJRPZFCR-AYMZKUIOSA-N -HMDB0044938 888.814591188 TG(18:0/18:1(9Z)/18:0) C57H108O6 RBLADLVPSYELCA-IKPAITLHSA-N -HMDB0044941 972.908491584 TG(18:0/18:1(9Z)/24:0) C63H120O6 JCJXSYIZXLFKNX-IUALHSBXSA-N -HMDB0044948 942.861541391 TG(18:0/18:1(9Z)/22:1(13Z)) C61H114O6 RQLZZCKGBZFETM-OUNLHQQGSA-N -HMDB0044949 970.89284152 TG(18:0/18:1(9Z)/24:1(15Z)) C63H118O6 AFCLJNCTQYJPGS-NAFTZFJHSA-N -HMDB0044951 882.767641004 TG(18:0/18:1(9Z)/18:3(6Z,9Z,12Z)) C57H102O6 JOJVDNJANFYSHZ-BEWFDITGSA-N -HMDB0044955 940.845891326 TG(18:0/18:1(9Z)/22:2(13Z,16Z)) C61H112O6 QHPYYZFXEDYENT-UYUVCTIRSA-N -HMDB0044958 882.767641004 TG(18:0/18:1(9Z)/18:3(9Z,12Z,15Z)) C57H102O6 BRLGHZXETDWABO-FCTLATDHSA-N -HMDB0044959 880.75199094 TG(18:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 IXDYCTWELIBSSO-OULNBDFMSA-N -HMDB0044964 874.835326642 TG(18:0/18:1(9Z)/o-18:0) C57H110O5 QGKVIRKDCRKDQI-GTJVTHKGSA-N -HMDB0044965 916.845891316 TG(18:0/20:1(11Z)/18:0) C59H112O6 OCUVIQQPCBIFRP-FVDSYPCUSA-N -HMDB0044967 972.908491584 TG(18:0/20:1(11Z)/22:0) C63H120O6 XXNKCKKMSRHNDQ-WNYHZXHYSA-N -HMDB0044971 914.830241262 TG(18:0/20:1(11Z)/18:1(11Z)) C59H110O6 GTGOXBMVMINSSB-BJXYBHFZSA-N -HMDB0044972 914.830241262 TG(18:0/20:1(11Z)/18:1(9Z)) C59H110O6 NQKRWZVYDJMTOX-MLZSESCUSA-N -HMDB0044974 938.830241262 TG(18:0/20:1(11Z)/20:3(5Z,8Z,11Z)) C61H110O6 NUAAGXVXOLBDRH-TXPZPBLZSA-N -HMDB0044975 970.89284152 TG(18:0/20:1(11Z)/22:1(13Z)) C63H118O6 OYNGPKGJSNVQOS-HQBPBTHXSA-N -HMDB0044979 940.845891326 TG(18:0/20:1(11Z)/20:2n6) C61H112O6 IOFQLHPECKLVSM-FLMLNZEISA-N -HMDB0044980 938.830241262 TG(18:0/20:1(11Z)/20:3n6) C61H110O6 NCJLYHVTMRUDRY-NQDOFZADSA-N -HMDB0044982 968.877191455 TG(18:0/20:1(11Z)/22:2(13Z,16Z)) C63H116O6 NSFHGSMSKWUULJ-VOZBUZFHSA-N -HMDB0044983 964.845891326 TG(18:0/20:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 IEMDRUBCZRDUKX-DOEHVUJYSA-N -HMDB0044984 962.830241262 TG(18:0/20:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 DWIFUTKZBKIVIO-PVSLLAIASA-N -HMDB0044989 962.830241262 TG(18:0/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 RPRUIZWBGFJFML-XUFMVWCYSA-N -HMDB0044991 902.866626771 TG(18:0/20:1(11Z)/o-18:0) C59H114O5 GFGMXYASPNDDEJ-DFOJIGQQSA-N -HMDB0044993 940.845891326 TG(18:0/20:3(5Z,8Z,11Z)/20:0) C61H112O6 VUMXXMHKLBIICK-RWKAMNIQSA-N -HMDB0044994 968.877191455 TG(18:0/20:3(5Z,8Z,11Z)/22:0) C63H116O6 IMFARGSEPLYKKO-BVTSHZFNSA-N -HMDB0044997 882.767641004 TG(18:0/20:3(5Z,8Z,11Z)/16:1(9Z)) C57H102O6 HGGUZVCKVZRCSS-QLUDRBNQSA-N -HMDB0045000 938.830241262 TG(18:0/20:3(5Z,8Z,11Z)/20:1(11Z)) C61H110O6 YUPFJKWSOWOCMK-BLBSEIANSA-N -HMDB0045002 966.861541391 TG(18:0/20:3(5Z,8Z,11Z)/22:1(13Z)) C63H114O6 VRWLAKNBXGYTIC-JURZGQHSSA-N -HMDB0045009 964.845891326 TG(18:0/20:3(5Z,8Z,11Z)/22:2(13Z,16Z)) C63H112O6 MCTXTKYETLGMSB-ZILCMUFCSA-N -HMDB0045011 958.798941133 TG(18:0/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 MQTQRKAUZZYKLD-NSJYWYAVSA-N -HMDB0045016 958.798941133 TG(18:0/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 LRLJXQHYZIWUEY-VEWYSBMJSA-N -HMDB0045017 956.783291069 TG(18:0/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 ZAABBQKBBZHIKW-HIGBRWCSSA-N -HMDB0045020 972.908491584 TG(18:0/22:1(13Z)/20:0) C63H120O6 YENXZCWCIMKQCY-HZLQDPIMSA-N -HMDB0045024 914.830241262 TG(18:0/22:1(13Z)/16:1(9Z)) C59H110O6 YXNAYHGGFGKLHS-HVYAKTSASA-N -HMDB0045025 942.861541391 TG(18:0/22:1(13Z)/18:1(11Z)) C61H114O6 FGOIRQZPYNSNTG-KIYGDOFBSA-N -HMDB0045026 942.861541391 TG(18:0/22:1(13Z)/18:1(9Z)) C61H114O6 HTXFYVWYFJNSRG-RWMORWPJSA-N -HMDB0045027 970.89284152 TG(18:0/22:1(13Z)/20:1(11Z)) C63H118O6 MRYNICMNUGGZAJ-HQBPBTHXSA-N -HMDB0045028 966.861541391 TG(18:0/22:1(13Z)/20:3(5Z,8Z,11Z)) C63H114O6 HBMHHUTWSLFSBG-OAHZRARMSA-N -HMDB0045031 940.845891326 TG(18:0/22:1(13Z)/18:2(9Z,12Z)) C61H112O6 BCDRZMKISYSJPP-CGSGPZGSSA-N -HMDB0045032 938.830241262 TG(18:0/22:1(13Z)/18:3(6Z,9Z,12Z)) C61H110O6 JWEMQLKKBMDMSC-UANQULQISA-N -HMDB0045033 968.877191455 TG(18:0/22:1(13Z)/20:2n6) C63H116O6 QXOPDZOQHIVILD-HHIZIFKISA-N -HMDB0045034 966.861541391 TG(18:0/22:1(13Z)/20:3n6) C63H114O6 NKVPAWUMBWESJM-XDRDHHGRSA-N -HMDB0045035 964.845891326 TG(18:0/22:1(13Z)/20:4(5Z,8Z,11Z,14Z)) C63H112O6 VRRPYVKHLUMVJX-BDPNYXBCSA-N -HMDB0045039 938.830241262 TG(18:0/22:1(13Z)/18:3(9Z,12Z,15Z)) C61H110O6 UVBMJNGWTCZEQF-PMEQYAFJSA-N -HMDB0045041 964.845891326 TG(18:0/22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C63H112O6 WFKRBGOCZSKULO-PSUWRVPUSA-N -HMDB0045042 962.830241262 TG(18:0/22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 MAHQPVANDQGZIN-NTNWIWTMSA-N -HMDB0045046 972.908491572 TG(18:0/24:1(15Z)/18:0) C63H120O6 KUKLTLNSTKLWOK-FVDSYPCUSA-N -HMDB0045050 914.830241262 TG(18:0/24:1(15Z)/14:1(9Z)) C59H110O6 SHPCUQLAGQRBSR-HYQPEPIUSA-N -HMDB0045051 942.861541391 TG(18:0/24:1(15Z)/16:1(9Z)) C61H114O6 HAZYEPTWRFLUON-GDBZVGQESA-N -HMDB0045052 970.89284152 TG(18:0/24:1(15Z)/18:1(11Z)) C63H118O6 KCZXAMVZIWNRAA-RNCMSDBXSA-N -HMDB0045053 970.89284152 TG(18:0/24:1(15Z)/18:1(9Z)) C63H118O6 DKLOEZUJIXIVSU-SXLFIPTDSA-N -HMDB0045058 968.877191455 TG(18:0/24:1(15Z)/18:2(9Z,12Z)) C63H116O6 ACFCSXYEAINHFR-JOOBHXTJSA-N -HMDB0045059 966.861541391 TG(18:0/24:1(15Z)/18:3(6Z,9Z,12Z)) C63H114O6 NXVPBQKOQAHIQZ-ZUPCQKIOSA-N -HMDB0045066 966.861541391 TG(18:0/24:1(15Z)/18:3(9Z,12Z,15Z)) C63H114O6 RWHDQXUEVMMABX-LDOFVRLXSA-N -HMDB0045067 964.845891326 TG(18:0/24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C63H112O6 JLGWZFFBMBENJB-KYXQNJKZSA-N -HMDB0045072 958.929227028 TG(18:0/24:1(15Z)/o-18:0) C63H122O5 WIUBICRACXYXHV-NYRYLARASA-N -HMDB0045075 942.861541391 TG(18:0/18:2(9Z,12Z)/22:0) C61H114O6 VTHDNMHRPKXWMZ-WMMWWMJFSA-N -HMDB0045076 970.89284152 TG(18:0/18:2(9Z,12Z)/24:0) C63H118O6 FUYKNMGGFRUDSS-XMDWGKHBSA-N -HMDB0045078 856.75199094 TG(18:0/18:2(9Z,12Z)/16:1(9Z)) C55H100O6 TZMQOSMAJITOAT-TWPJAYPBSA-N -HMDB0045079 884.783291069 TG(18:0/18:2(9Z,12Z)/18:1(11Z)) C57H104O6 OKAAPUQYUHINCC-JPAMPYFZSA-N -HMDB0045080 884.783291069 TG(18:0/18:2(9Z,12Z)/18:1(9Z)) C57H104O6 AAXMCYUUKFLUMJ-JSFHAIONSA-N -HMDB0045083 940.845891326 TG(18:0/18:2(9Z,12Z)/22:1(13Z)) C61H112O6 AGXFHKUZXQPREM-VBDNUALRSA-N -HMDB0045084 968.877191455 TG(18:0/18:2(9Z,12Z)/24:1(15Z)) C63H116O6 PEXSAAMYDXHXJR-KUDLTUAXSA-N -HMDB0045086 880.75199094 TG(18:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) C57H100O6 FOOVNYMOCOZYCS-FEJMAITCSA-N -HMDB0045090 938.830241262 TG(18:0/18:2(9Z,12Z)/22:2(13Z,16Z)) C61H110O6 OZEFVBNHXBHBOW-JMKRSAAASA-N -HMDB0045093 880.75199094 TG(18:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C57H100O6 CFIAQJQGPHURGU-YRSSWLJYSA-N -HMDB0045100 884.78329106 TG(18:0/18:3(6Z,9Z,12Z)/18:0) C57H104O6 SXDAWDWMVQAQOY-BXDHOHHHSA-N -HMDB0045102 940.845891326 TG(18:0/18:3(6Z,9Z,12Z)/22:0) C61H112O6 QUXKGFALHOZZDI-BLAZJOSUSA-N -HMDB0045103 968.877191455 TG(18:0/18:3(6Z,9Z,12Z)/24:0) C63H116O6 JTJZUFAYMWLIGR-GFXRHTKRSA-N -HMDB0045106 882.767641004 TG(18:0/18:3(6Z,9Z,12Z)/18:1(11Z)) C57H102O6 JIYHMQDXQDVDIQ-UWWYLVAFSA-N -HMDB0045107 882.767641004 TG(18:0/18:3(6Z,9Z,12Z)/18:1(9Z)) C57H102O6 JLLNDMXBRCFCMO-HMUWYHQJSA-N -HMDB0045110 938.830241262 TG(18:0/18:3(6Z,9Z,12Z)/22:1(13Z)) C61H110O6 NWCGBGIXJBNACP-ZAXCPQCGSA-N -HMDB0045111 966.861541391 TG(18:0/18:3(6Z,9Z,12Z)/24:1(15Z)) C63H114O6 XZCFLUUMROMSAR-PXKUIHTLSA-N -HMDB0045112 880.75199094 TG(18:0/18:3(6Z,9Z,12Z)/18:2(9Z,12Z)) C57H100O6 FHKXPCWAEDEJKG-LEDSTZLCSA-N -HMDB0045126 870.804026513 TG(18:0/18:3(6Z,9Z,12Z)/o-18:0) C57H106O5 OSNTYLCOCUHBGM-QMUGSFBZSA-N -HMDB0045127 914.830241262 TG(18:0/20:2n6/18:0) C59H110O6 OKJDYZDDQFURDR-LVBVOWIESA-N -HMDB0045128 942.861541391 TG(18:0/20:2n6/20:0) C61H114O6 QPDHZEQJAFYSNE-FPHZGZEOSA-N -HMDB0045129 970.89284152 TG(18:0/20:2n6/22:0) C63H118O6 UEPNNQMHGKLSKK-ZTVVXRKDSA-N -HMDB0045131 856.75199094 TG(18:0/20:2n6/14:1(9Z)) C55H100O6 UJRVGGIOIJYNLP-INLODCDNSA-N -HMDB0045132 884.783291069 TG(18:0/20:2n6/16:1(9Z)) C57H104O6 UEOJWPZDTKLQJA-ISJYKPTOSA-N -HMDB0045135 940.845891326 TG(18:0/20:2n6/20:1(11Z)) C61H112O6 YRNOILAKWQZJOO-CXWPALGVSA-N -HMDB0045137 968.877191455 TG(18:0/20:2n6/22:1(13Z)) C63H116O6 VFMVVXVFRDLZMQ-HHIZIFKISA-N -HMDB0045141 938.830241262 TG(18:0/20:2n6/20:2n6) C61H110O6 SBHOBWMHSSIWIO-CLBRXFEDSA-N -HMDB0045144 966.861541391 TG(18:0/20:2n6/22:2(13Z,16Z)) C63H114O6 GNKDSUNTVMVVBM-OGRIISAJSA-N -HMDB0045145 962.830241262 TG(18:0/20:2n6/22:4(7Z,10Z,13Z,16Z)) C63H110O6 NKQWVJHGQMXCFY-CWBHPBIOSA-N 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TG(18:0/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 KWKOUCDAAANDPY-PRKOOHHZSA-N -HMDB0045182 938.830241262 TG(18:0/20:4(5Z,8Z,11Z,14Z)/20:0) C61H110O6 PCXVFXRDXMNRHE-PYRCLQTDSA-N -HMDB0045183 966.861541391 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:0) C63H114O6 VLOCCOVTRWLMEU-ZTPDLCGESA-N -HMDB0045185 852.720690811 TG(18:0/20:4(5Z,8Z,11Z,14Z)/14:1(9Z)) C55H96O6 STRGYEHUWWQWTA-LSNMNOJMSA-N -HMDB0045186 880.75199094 TG(18:0/20:4(5Z,8Z,11Z,14Z)/16:1(9Z)) C57H100O6 UOLSYLSXKGOQQK-VRBYCHNISA-N -HMDB0045191 964.845891326 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:1(13Z)) C63H112O6 RXSFIMVOIADAFE-VFUVEHBSSA-N -HMDB0045198 962.830241262 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)) C63H110O6 YJELIPRHDFZGTI-YDRLPFBYSA-N -HMDB0045199 958.798941133 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 MBYYMZUVLLYROS-XFVWFZJZSA-N -HMDB0045200 956.783291069 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 VKCTUXDPTHSMPZ-NLYINHNWSA-N -HMDB0045205 956.783291069 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 VDTUMEBCKWSEJW-OFDFIMGJSA-N -HMDB0045206 954.767641004 TG(18:0/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 KKJGCGBAFKPDGN-AXQNHMBDSA-N -HMDB0045208 942.86154138 TG(18:0/22:2(13Z,16Z)/18:0) C61H114O6 QDDFZEYQURVBHO-LVBVOWIESA-N -HMDB0045209 970.89284152 TG(18:0/22:2(13Z,16Z)/20:0) C63H118O6 LPELEKIVSWFLKI-NUXSQISZSA-N -HMDB0045212 884.783291069 TG(18:0/22:2(13Z,16Z)/14:1(9Z)) C57H104O6 FWBKQSARGDXJLH-VZKMDISCSA-N -HMDB0045214 940.845891326 TG(18:0/22:2(13Z,16Z)/18:1(11Z)) C61H112O6 FTTKNOTUTROZKZ-UHSNCZLYSA-N -HMDB0045215 940.845891326 TG(18:0/22:2(13Z,16Z)/18:1(9Z)) C61H112O6 QDZSNMGLSOCIKD-FWIVFOPYSA-N -HMDB0045216 968.877191455 TG(18:0/22:2(13Z,16Z)/20:1(11Z)) C63H116O6 CMYGJOFGWDPRGY-VOZBUZFHSA-N -HMDB0045217 964.845891326 TG(18:0/22:2(13Z,16Z)/20:3(5Z,8Z,11Z)) C63H112O6 IDAQDJPLYHWOKS-NHIUTETASA-N -HMDB0045220 938.830241262 TG(18:0/22:2(13Z,16Z)/18:2(9Z,12Z)) C61H110O6 NMZIXCZQAKUEKO-QYODDPQFSA-N -HMDB0045222 966.861541391 TG(18:0/22:2(13Z,16Z)/20:2n6) C63H114O6 KWEJHHHDBVLFPL-OGRIISAJSA-N -HMDB0045223 964.845891326 TG(18:0/22:2(13Z,16Z)/20:3n6) C63H112O6 LUUMBKHGQRFUNQ-USJUBNGZSA-N -HMDB0045224 962.830241262 TG(18:0/22:2(13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 HCLNENGBRCSTJE-XCHDHFLKSA-N -HMDB0045230 962.830241262 TG(18:0/22:2(13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 FSLGMQVJEHZUPJ-AUPDOVKISA-N -HMDB0045234 928.882276835 TG(18:0/22:2(13Z,16Z)/o-18:0) C61H116O5 QGNLJGRXJOVVCH-UWVPRLFQSA-N -HMDB0045235 938.830241252 TG(18:0/22:4(7Z,10Z,13Z,16Z)/18:0) C61H110O6 WWQOKYMMBUGAPO-CXWWEHRMSA-N -HMDB0045236 966.861541391 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:0) C63H114O6 YFYCCMUWMOKMGJ-LQAARTKHSA-N -HMDB0045239 880.75199094 TG(18:0/22:4(7Z,10Z,13Z,16Z)/14:1(9Z)) C57H100O6 UWNCWDLVLHBCRO-IVXNCYSKSA-N -HMDB0045243 964.845891326 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:1(11Z)) C63H112O6 GTTMZICIVQUFGN-KWAHJTBNSA-N -HMDB0045249 962.830241262 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:2n6) C63H110O6 DHFHFDYQWHOMJO-CSOAMPEQSA-N -HMDB0045251 958.798941133 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 QEBZICHWOFBWMS-BXBPZLISSA-N -HMDB0045257 958.798941133 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 ZFXYDOMFBWQZNA-OEPLPROGSA-N -HMDB0045258 956.783291069 TG(18:0/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 PAKBTZYUUDHYDL-OZZJIWKISA-N -HMDB0045261 924.850976706 TG(18:0/22:4(7Z,10Z,13Z,16Z)/o-18:0) C61H112O5 HLHOFQHIUQLVAE-RHNCSCFFSA-N -HMDB0045263 964.845891326 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:0) C63H112O6 MWJBYDLBNUIUKI-ZVKHHTNOSA-N -HMDB0045270 962.830241262 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)) C63H110O6 FOIBEFNGSFFBMC-WMWAADGMSA-N -HMDB0045271 958.798941133 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)) C63H106O6 JLSNFGORYGPKQA-XEZSGRQCSA-N -HMDB0045277 958.798941133 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:3n6) C63H106O6 CDFAJARHNVKXPZ-AESULGNNSA-N -HMDB0045278 956.783291069 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 WDAMDABFGGIOBB-NDXZBYJQSA-N -HMDB0045284 956.783291069 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 RBJAIGDUPAACLQ-QFBUTMHNSA-N -HMDB0045285 954.767641004 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 OHFJEIHIIZLXHT-HVUXWFRBSA-N -HMDB0045287 980.783291069 TG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 FRFQSYRDVBGUBF-KTGBSMIYSA-N -HMDB0045289 884.78329106 TG(18:0/18:3(9Z,12Z,15Z)/18:0) C57H104O6 YJHQECFFCOYQLS-YTMLWYSLSA-N -HMDB0045291 940.845891326 TG(18:0/18:3(9Z,12Z,15Z)/22:0) C61H112O6 VIGAYEURCPHMGZ-UDRAQAHNSA-N -HMDB0045292 968.877191455 TG(18:0/18:3(9Z,12Z,15Z)/24:0) C63H116O6 CCTFWKNIQDIFGW-BDPSZCGGSA-N -HMDB0045295 882.767641004 TG(18:0/18:3(9Z,12Z,15Z)/18:1(11Z)) C57H102O6 HIOAMCRVNLXZQC-CTRCWUJRSA-N -HMDB0045296 882.767641004 TG(18:0/18:3(9Z,12Z,15Z)/18:1(9Z)) C57H102O6 APUGAHTVBGXVKV-MRUQREPFSA-N -HMDB0045299 938.830241262 TG(18:0/18:3(9Z,12Z,15Z)/22:1(13Z)) C61H110O6 JYQPRHZKULXQCI-MAWJDQTHSA-N -HMDB0045300 966.861541391 TG(18:0/18:3(9Z,12Z,15Z)/24:1(15Z)) C63H114O6 JYQSHOWOAIDEJS-PEPBPGFISA-N -HMDB0045301 880.75199094 TG(18:0/18:3(9Z,12Z,15Z)/18:2(9Z,12Z)) C57H100O6 NYFNHSSPUMHKRM-ANIFFHRWSA-N -HMDB0045315 870.804026513 TG(18:0/18:3(9Z,12Z,15Z)/o-18:0) C57H106O5 YZSJMIBWBNKODT-AAHAZSIPSA-N -HMDB0045316 882.767640996 TG(18:0/18:4(6Z,9Z,12Z,15Z)/18:0) C57H102O6 DJYNSHLHLLYWLD-QWZXXBLSSA-N -HMDB0045318 938.830241262 TG(18:0/18:4(6Z,9Z,12Z,15Z)/22:0) C61H110O6 DQHAGOJZQAKIDI-BAZNXKAYSA-N -HMDB0045319 966.861541391 TG(18:0/18:4(6Z,9Z,12Z,15Z)/24:0) C63H114O6 NIUHSZFZGDYMCJ-PFBNTUQISA-N -HMDB0045321 852.720690811 TG(18:0/18:4(6Z,9Z,12Z,15Z)/16:1(9Z)) C55H96O6 ASJHAVAPNBVXQH-PXMRWORUSA-N -HMDB0045322 880.75199094 TG(18:0/18:4(6Z,9Z,12Z,15Z)/18:1(11Z)) C57H100O6 VCXOXNIREQFVQW-NYUCNPOMSA-N -HMDB0045323 880.75199094 TG(18:0/18:4(6Z,9Z,12Z,15Z)/18:1(9Z)) C57H100O6 YIJBKAITYUJKQL-LDXVSRRQSA-N -HMDB0045327 964.845891326 TG(18:0/18:4(6Z,9Z,12Z,15Z)/24:1(15Z)) C63H112O6 UGSOYIWJZWSYGO-IFGLFFKQSA-N 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TG(18:0/20:4(8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 AKYYZUWPIITYAK-HJJVPOESSA-N -HMDB0045367 956.783291069 TG(18:0/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 VGDHPALBZNZOAN-JMTVFVGRSA-N -HMDB0045368 954.767641004 TG(18:0/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 RXVLBDOYHGQIHF-SWXKNVJDSA-N -HMDB0045372 964.845891326 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:0) C63H112O6 UGESMJAODJVYKL-QJOGIDDNSA-N -HMDB0045380 962.830241262 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:1(13Z)) C63H110O6 BHSZPPTYGRFCSI-AWMQCPORSA-N -HMDB0045388 956.783291069 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 FUFCCGBYLOBWHP-GCJOXKIISA-N -HMDB0045389 954.767641004 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 WEHFEWQFZHCTSK-CJVFTWQWSA-N -HMDB0045391 900.720690811 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 HQMVQKBESXYEOV-RDXPTAAPSA-N -HMDB0045394 954.767641004 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 OHSCTPYVQBIXJB-JOVICSMISA-N -HMDB0045395 952.75199094 TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 ORHRYJKHSZANHP-RHLDFOEISA-N -HMDB0045398 964.845891326 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:0) C63H112O6 DSTCTJRXZHFEEO-CYHCANLKSA-N -HMDB0045405 962.830241262 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:1(11Z)) C63H110O6 DWQZBCMNGWIPJK-AKRVDTJHSA-N -HMDB0045406 958.798941133 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C63H106O6 BRPUMZUOUUAVGA-QZXWPPGBSA-N -HMDB0045412 958.798941133 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:3n6) C63H106O6 FFMPGKXDJNLCRV-RTLLCJTESA-N -HMDB0045413 956.783291069 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 XOMMIQREYDPKRF-FMYHXWRUSA-N -HMDB0045419 956.783291069 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 IUMDGPNWURWSCV-FJBSQTRCSA-N -HMDB0045420 954.767641004 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 QAMWFCYOJWMYOC-SBGMQPKRSA-N -HMDB0045422 980.783291069 TG(18:0/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 NHOONBFZUMWOFW-OWQGDOAGSA-N -HMDB0045425 962.830241262 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:0) C63H110O6 NFFNDBLEGQCYOX-TWKXXNKTSA-N -HMDB0045433 956.783291069 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C63H104O6 SXAAWCNXDWGCLB-WVVQKHDVSA-N -HMDB0045438 958.798941133 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2n6) C63H106O6 FTHLMZICSLNUNG-RFAFCCPUSA-N -HMDB0045439 956.783291069 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6) C63H104O6 QWLKJDKJCFMSGB-OZQFVIIKSA-N -HMDB0045440 954.767641004 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 JGZAQTBYJIAXMB-IQVPNVFRSA-N -HMDB0045443 980.783291069 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 UURRRKGAHHCVSI-ATWVAKFQSA-N -HMDB0045446 954.767641004 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 HOJKDYMVHKKNHI-KDGBUHMYSA-N -HMDB0045447 952.75199094 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 RGEZBXPRDPDBNY-NHHCUWNXSA-N -HMDB0045448 980.783291069 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 OTFHEYIENBSGTP-HZMSJLSZSA-N -HMDB0045449 978.767641004 TG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 POVKTGOFOJWXMA-VQHKAUGWSA-N -HMDB0045457 874.835326642 TG(18:0/o-18:0/18:1(11Z)) C57H110O5 OLZRHDMTTQNXSI-ORXJQOAGSA-N -HMDB0045458 874.835326642 TG(18:0/o-18:0/18:1(9Z)) C57H110O5 MCIPPLJLYFTODM-OVDKEJHLSA-N -HMDB0045459 902.866626771 TG(18:0/o-18:0/20:1(11Z)) C59H114O5 YEMQFZGWRFYGJM-CUASBFQXSA-N -HMDB0045462 958.929227028 TG(18:0/o-18:0/24:1(15Z)) C63H122O5 WITFBADACYFOQN-SBOILKGHSA-N -HMDB0045464 870.804026513 TG(18:0/o-18:0/18:3(6Z,9Z,12Z)) C57H106O5 LLAVCIGKJBNPIR-LRZOXXFJSA-N -HMDB0045465 900.850976706 TG(18:0/o-18:0/20:2n6) C59H112O5 RPLBRIYXQKGFND-NRCLJHGGSA-N -HMDB0045468 928.882276835 TG(18:0/o-18:0/22:2(13Z,16Z)) C61H116O5 BEJINFUEKQSHML-ADMBXHAWSA-N -HMDB0045469 924.850976706 TG(18:0/o-18:0/22:4(7Z,10Z,13Z,16Z)) C61H112O5 FCSMYJQXGWBEFO-XNWOAGELSA-N -HMDB0045471 870.804026513 TG(18:0/o-18:0/18:3(9Z,12Z,15Z)) C57H106O5 WNIDTLACSIPEOD-QZRROOOBSA-N -HMDB0045472 868.788376449 TG(18:0/o-18:0/18:4(6Z,9Z,12Z,15Z)) C57H104O5 DWWVDERGXAMHFX-FRVOMFDKSA-N -HMDB0045484 888.814591198 TG(20:0/14:0/20:1(11Z)) C57H108O6 BWOHNVUJJCXFQP-RIIZGYGHSA-N -HMDB0045485 884.783291069 TG(20:0/14:0/20:3(5Z,8Z,11Z)) C57H104O6 PYZPMTALAXHGCB-CAWRAVACSA-N -HMDB0045486 916.845891326 TG(20:0/14:0/22:1(13Z)) C59H112O6 IPYRBHTYCZWCET-LIZMGIQCSA-N -HMDB0045489 856.75199094 TG(20:0/14:0/18:3(6Z,9Z,12Z)) C55H100O6 VNKAHKVFGRGTQD-BZTWIAFQSA-N -HMDB0045491 884.783291069 TG(20:0/14:0/20:3n6) C57H104O6 HEZIFHPOCSMIRI-SBIMNFJZSA-N -HMDB0045492 882.767641004 TG(20:0/14:0/20:4(5Z,8Z,11Z,14Z)) C57H102O6 SQKYADYBUNVMCF-TZKWBVHZSA-N -HMDB0045493 914.830241262 TG(20:0/14:0/22:2(13Z,16Z)) C59H110O6 SYGFOSKNZKVBDP-KNAYTQRDSA-N -HMDB0045496 856.75199094 TG(20:0/14:0/18:3(9Z,12Z,15Z)) C55H100O6 CHGVHAOSWOJCHZ-ZNVCVHDVSA-N -HMDB0045498 882.767641004 TG(20:0/14:0/20:4(8Z,11Z,14Z,17Z)) C57H102O6 OAWZXYQFSSUDQG-RVRVDDSXSA-N -HMDB0045499 880.75199094 TG(20:0/14:0/20:5(5Z,8Z,11Z,14Z,17Z)) C57H100O6 JBRTUJBXWSKTAY-XDMDWMGJSA-N -HMDB0045511 898.798941133 TG(20:0/15:0/20:3(5Z,8Z,11Z)) C58H106O6 ASJDYPQIFWQJPP-DFBVFTRISA-N -HMDB0045517 898.798941133 TG(20:0/15:0/20:3n6) C58H106O6 MGWARNQTGMPDFT-YGNDMOEESA-N -HMDB0045518 896.783291069 TG(20:0/15:0/20:4(5Z,8Z,11Z,14Z)) C58H104O6 SEEXZSJWUOGTDD-IBHLQUFFSA-N -HMDB0045524 896.783291069 TG(20:0/15:0/20:4(8Z,11Z,14Z,17Z)) C58H104O6 UJUOOWYFRZLMGP-TVZXMLSKSA-N -HMDB0045534 888.814591198 TG(20:0/16:0/18:1(11Z)) C57H108O6 ZAQSWHTVZWGPPD-WTNBXCFCSA-N -HMDB0045535 888.814591198 TG(20:0/16:0/18:1(9Z)) C57H108O6 YPMNDOUIDVDQOW-CZTCNMGMSA-N -HMDB0045536 916.845891326 TG(20:0/16:0/20:1(11Z)) C59H112O6 KAKUNEKXMAHXNF-VXVUXWGWSA-N -HMDB0045539 972.908491584 TG(20:0/16:0/24:1(15Z)) C63H120O6 MYQZXEILKZNHFK-HBFRPXMKSA-N -HMDB0045541 884.783291069 TG(20:0/16:0/18:3(6Z,9Z,12Z)) C57H104O6 XYQFDSGKFQESCN-KEWDIONSSA-N -HMDB0045542 914.830241262 TG(20:0/16:0/20:2n6) C59H110O6 VTPICOUFYQJTJI-HAVOCZCHSA-N -HMDB0045545 942.861541391 TG(20:0/16:0/22:2(13Z,16Z)) C61H114O6 POSPEMGIHZMKBT-KMHMPRQHSA-N -HMDB0045546 938.830241262 TG(20:0/16:0/22:4(7Z,10Z,13Z,16Z)) C61H110O6 MPLJLGNREKLWNT-CDBIGVDSSA-N -HMDB0045548 884.783291069 TG(20:0/16:0/18:3(9Z,12Z,15Z)) C57H104O6 LJYSOCUILOBCPA-DXRFALFFSA-N -HMDB0045549 882.767641004 TG(20:0/16:0/18:4(6Z,9Z,12Z,15Z)) C57H102O6 JWVUDERNGFMBBB-UYIKSULZSA-N -HMDB0045559 888.814591188 TG(20:0/18:0/16:1(9Z)) C57H108O6 UTGDZOIOODXGAH-YWGGJCCTSA-N -HMDB0045560 916.845891326 TG(20:0/18:0/18:1(11Z)) C59H112O6 NDDBFQIGGOFJRX-BUKBLQRKSA-N -HMDB0045561 916.845891326 TG(20:0/18:0/18:1(9Z)) C59H112O6 WOYJJCSXKNHKCN-KMWQWKMBSA-N -HMDB0045563 940.845891326 TG(20:0/18:0/20:3(5Z,8Z,11Z)) C61H112O6 IUCQBMBRIJLQCE-IARNVVBISA-N -HMDB0045564 972.908491584 TG(20:0/18:0/22:1(13Z)) C63H120O6 UXJYWOFCVLKPDF-HZLQDPIMSA-N -HMDB0045566 914.830241262 TG(20:0/18:0/18:2(9Z,12Z)) C59H110O6 FEWUEBYAXQMTPT-BSPWMJLXSA-N -HMDB0045568 942.861541391 TG(20:0/18:0/20:2n6) C61H114O6 FCHJVBOWMICKJA-UAUPZCQFSA-N -HMDB0045569 940.845891326 TG(20:0/18:0/20:3n6) C61H112O6 KPIFNDIZKFVARX-SIPJOPBTSA-N -HMDB0045570 938.830241262 TG(20:0/18:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 SALMPXKLCVMTMW-VIDXZENWSA-N -HMDB0045571 970.89284152 TG(20:0/18:0/22:2(13Z,16Z)) C63H118O6 DNBLIASYUOJINW-NUXSQISZSA-N -HMDB0045572 966.861541391 TG(20:0/18:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 NZBRMZMLPIKHLK-ZKHXJDFVSA-N -HMDB0045573 964.845891326 TG(20:0/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 XYNZLONPOFRLJB-AZQLJNOYSA-N -HMDB0045576 938.830241262 TG(20:0/18:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 GSYLODJVGAPZPZ-KQSOXEKQSA-N -HMDB0045578 964.845891326 TG(20:0/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 YJBBKAQEXQATDN-SHMLEVFJSA-N -HMDB0045579 962.830241262 TG(20:0/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 APPYUQSCODMKIN-AKZASNDYSA-N -HMDB0045584 888.814591198 TG(20:0/20:0/14:1(9Z)) C57H108O6 IUDLXSDWDIHVDD-IXHOOSMISA-N -HMDB0045585 916.845891316 TG(20:0/20:0/16:1(9Z)) C59H112O6 KJVYOEKCDNOOAP-SZPKOVDMSA-N -HMDB0045589 968.877191455 TG(20:0/20:0/20:3(5Z,8Z,11Z)) C63H116O6 HQKSQUGAHISWQN-QVFOBYJHSA-N -HMDB0045592 942.86154138 TG(20:0/20:0/18:2(9Z,12Z)) C61H114O6 VYGDFJHLNCSFJZ-GDTJZKNMSA-N -HMDB0045593 940.845891326 TG(20:0/20:0/18:3(6Z,9Z,12Z)) C61H112O6 AQYRONSXFRXAPZ-OPULACOYSA-N -HMDB0045594 970.89284152 TG(20:0/20:0/20:2n6) C63H118O6 IURMBXSVKSWAOA-UKFOTICSSA-N -HMDB0045595 968.877191455 TG(20:0/20:0/20:3n6) C63H116O6 SKYYKLLKGOJLMR-CZCJEMLCSA-N -HMDB0045600 940.845891326 TG(20:0/20:0/18:3(9Z,12Z,15Z)) C61H112O6 SJKUKFUWJWEPFD-AHYWTYHESA-N -HMDB0045601 938.830241262 TG(20:0/20:0/18:4(6Z,9Z,12Z,15Z)) C61H110O6 GFKHXQTZIPZMNW-OEBPQYFJSA-N -HMDB0045602 966.861541391 TG(20:0/20:0/20:4(8Z,11Z,14Z,17Z)) C63H114O6 JVDSXKOHBLWGIM-ZAUMMMGXSA-N -HMDB0045603 964.845891326 TG(20:0/20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O6 ZKCPJGUEGWADAV-MOJDRSRPSA-N -HMDB0045610 916.845891326 TG(20:0/22:0/14:1(9Z)) C59H112O6 WJSBURXJPCGRCH-AAABZKSKSA-N -HMDB0045612 972.908491584 TG(20:0/22:0/18:1(11Z)) C63H120O6 VZNQKMLGTXDQIH-RXNSVRMPSA-N -HMDB0045613 972.908491584 TG(20:0/22:0/18:1(9Z)) C63H120O6 KIOWNTIUPBZKFY-YAOUCAOSSA-N -HMDB0045618 970.89284152 TG(20:0/22:0/18:2(9Z,12Z)) C63H118O6 YITUAXAQLSWWNX-GZBHRQIQSA-N -HMDB0045619 968.877191455 TG(20:0/22:0/18:3(6Z,9Z,12Z)) C63H116O6 HRIZOSOLJUQKSO-RKJQRDPNSA-N -HMDB0045626 968.877191455 TG(20:0/22:0/18:3(9Z,12Z,15Z)) C63H116O6 UXLOFYOLOKXYAP-SRUIGVKTSA-N -HMDB0045627 966.861541391 TG(20:0/22:0/18:4(6Z,9Z,12Z,15Z)) C63H114O6 ALFAYLAQUMDHCM-LHFRGBNGSA-N -HMDB0045637 972.908491584 TG(20:0/24:0/16:1(9Z)) C63H120O6 FOUWGWGSPVWLRF-RXNSVRMPSA-N -HMDB0045659 888.814591188 TG(20:0/14:1(9Z)/20:0) C57H108O6 XNLCSBIDDKARLA-SDXDJHTJSA-N -HMDB0045660 916.845891326 TG(20:0/14:1(9Z)/22:0) C59H112O6 SSQAVJZOEYXKJM-YCJNRUSJSA-N -HMDB0045667 882.767641004 TG(20:0/14:1(9Z)/20:3(5Z,8Z,11Z)) C57H102O6 HLPJZXVCHWKDNK-RPVBRVSLSA-N -HMDB0045668 914.830241262 TG(20:0/14:1(9Z)/22:1(13Z)) C59H110O6 HWPRTUFRMUOZLY-AZKDRWSUSA-N -HMDB0045669 942.861541391 TG(20:0/14:1(9Z)/24:1(15Z)) C61H114O6 SBZHRFMQIXHJRW-GWPMROEHSA-N -HMDB0045670 856.75199094 TG(20:0/14:1(9Z)/18:2(9Z,12Z)) C55H100O6 SGNGDCVKDGTDQC-MMLIVBKMSA-N -HMDB0045672 884.783291069 TG(20:0/14:1(9Z)/20:2n6) C57H104O6 NFCQXICLNHGVGZ-VZKMDISCSA-N -HMDB0045673 882.767641004 TG(20:0/14:1(9Z)/20:3n6) C57H102O6 ZXXXFPVLDMZBCA-BJTIWZRUSA-N -HMDB0045674 880.751990932 TG(20:0/14:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C57H100O6 GWNUSEKGRALKED-IBFIZYGQSA-N -HMDB0045679 852.720690811 TG(20:0/14:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C55H96O6 GRVZQIMVHTZJHB-FDIDEQADSA-N -HMDB0045680 880.75199094 TG(20:0/14:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C57H100O6 UHJOVPMFQXZMGP-HFCNGZNYSA-N -HMDB0045685 916.845891316 TG(20:0/16:1(9Z)/20:0) C59H112O6 VNHABZLRSOJWDZ-FLFQWRMESA-N -HMDB0045687 972.908491584 TG(20:0/16:1(9Z)/24:0) C63H120O6 HGCINVBTERQPJG-VZKFWILHSA-N -HMDB0045692 914.830241262 TG(20:0/16:1(9Z)/20:1(11Z)) C59H110O6 CWYJHSJCZIYZKB-HVYAKTSASA-N -HMDB0045694 942.861541391 TG(20:0/16:1(9Z)/22:1(13Z)) C61H114O6 SQGUGCCVMDVBJZ-RHKJSXQCSA-N -HMDB0045695 970.89284152 TG(20:0/16:1(9Z)/24:1(15Z)) C63H118O6 WPQGJCCBOJSBDL-ZCSYOJTKSA-N -HMDB0045696 884.783291069 TG(20:0/16:1(9Z)/18:2(9Z,12Z)) C57H104O6 BXZBVJMLHIMPCY-YNTROPROSA-N -HMDB0045697 882.767641004 TG(20:0/16:1(9Z)/18:3(6Z,9Z,12Z)) C57H102O6 OCSXULFZMSSXID-HISUVNPSSA-N -HMDB0045701 940.845891326 TG(20:0/16:1(9Z)/22:2(13Z,16Z)) C61H112O6 NIFYGEMZMKSOKK-TXAPXYFQSA-N -HMDB0045704 882.767641004 TG(20:0/16:1(9Z)/18:3(9Z,12Z,15Z)) C57H102O6 RHCHGASZNFDFNT-GBISFHARSA-N -HMDB0045705 880.75199094 TG(20:0/16:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 IZLQMMZWIGPZNX-UMCZRHFJSA-N -HMDB0045710 874.835326642 TG(20:0/16:1(9Z)/o-18:0) C57H110O5 NFECCYXCUXSJJQ-AYMZKUIOSA-N -HMDB0045712 972.908491584 TG(20:0/18:1(11Z)/22:0) C63H120O6 JBGIIZRJUJAGJD-VZKFWILHSA-N -HMDB0045716 914.830241262 TG(20:0/18:1(11Z)/18:1(11Z)) C59H110O6 GYPCYQZGNPPXQY-ZLUYPCRLSA-N -HMDB0045717 914.830241262 TG(20:0/18:1(11Z)/18:1(9Z)) C59H110O6 DSLDDCZRINWODJ-XQZFORPWSA-N -HMDB0045718 942.861541391 TG(20:0/18:1(11Z)/20:1(11Z)) C61H114O6 WHMKXKHZNZAKLF-XXRULANTSA-N -HMDB0045719 938.830241262 TG(20:0/18:1(11Z)/20:3(5Z,8Z,11Z)) C61H110O6 YMNDWXQHOZTTQG-DBPNIQDOSA-N -HMDB0045720 970.89284152 TG(20:0/18:1(11Z)/22:1(13Z)) C63H118O6 ONAJSAYDJRBCNQ-WCGXTGDWSA-N -HMDB0045724 940.845891326 TG(20:0/18:1(11Z)/20:2n6) C61H112O6 WNFYWKVDGNONSX-XXMUPYQTSA-N -HMDB0045725 938.830241262 TG(20:0/18:1(11Z)/20:3n6) C61H110O6 JWRLQVQWCRUWFY-GKGBZLNTSA-N -HMDB0045727 968.877191455 TG(20:0/18:1(11Z)/22:2(13Z,16Z)) C63H116O6 MJLWCZOZMFQAGA-LTSCPUBNSA-N -HMDB0045728 964.845891326 TG(20:0/18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 YIENLPUFSVQUCG-QUTOEGKMSA-N -HMDB0045729 962.830241262 TG(20:0/18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 OUVOMMBEDVUBQG-ZXZGDFTBSA-N -HMDB0045734 962.830241262 TG(20:0/18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 QYDFSMCMLCRFHQ-CTDBYVDHSA-N -HMDB0045736 902.866626771 TG(20:0/18:1(11Z)/o-18:0) C59H114O5 TWOFGMYMSNEEJX-COAUFNLESA-N -HMDB0045738 972.908491584 TG(20:0/18:1(9Z)/22:0) C63H120O6 GTQFAXDJIANZMD-JWYLQQGLSA-N -HMDB0045742 914.830241262 TG(20:0/18:1(9Z)/18:1(11Z)) C59H110O6 XPLCSZBQAQAYRD-KMMAEHPZSA-N -HMDB0045743 914.830241252 TG(20:0/18:1(9Z)/18:1(9Z)) C59H110O6 JFKGKULDMWLHEK-KMERLIGUSA-N -HMDB0045744 942.861541391 TG(20:0/18:1(9Z)/20:1(11Z)) C61H114O6 UKGTYUIMAQPUNI-WLPFSFTESA-N -HMDB0045745 938.830241262 TG(20:0/18:1(9Z)/20:3(5Z,8Z,11Z)) C61H110O6 OEUMFZWSMUCXBP-UTCXMCAGSA-N -HMDB0045746 970.89284152 TG(20:0/18:1(9Z)/22:1(13Z)) C63H118O6 WKGFMQTYNRBSTK-IZQICMPYSA-N -HMDB0045750 940.845891326 TG(20:0/18:1(9Z)/20:2n6) C61H112O6 SJSPRNUEKGVEFR-JPFWVNQASA-N -HMDB0045751 938.830241262 TG(20:0/18:1(9Z)/20:3n6) C61H110O6 ASPJACHPVRBOQP-NSOWXUSTSA-N -HMDB0045753 968.877191455 TG(20:0/18:1(9Z)/22:2(13Z,16Z)) C63H116O6 BWVMXRNTJKNLIG-VQWJJQQVSA-N -HMDB0045754 964.845891326 TG(20:0/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 MRZUKESUWGFNGN-FKMGPEFTSA-N -HMDB0045755 962.830241262 TG(20:0/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 NLINQQFDCCGNFE-GRHYHTISSA-N -HMDB0045760 962.830241262 TG(20:0/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 HLJUWCMJURHSAS-WEMJJBFYSA-N -HMDB0045762 902.866626771 TG(20:0/18:1(9Z)/o-18:0) C59H114O5 VRZHAFWZMYJZMD-LKKPSHJRSA-N -HMDB0045763 972.908491572 TG(20:0/20:1(11Z)/20:0) C63H120O6 VNTAEBMTULPOLY-IKPAITLHSA-N -HMDB0045767 914.830241262 TG(20:0/20:1(11Z)/16:1(9Z)) C59H110O6 ITRVDAWLKSPAKB-JINDPDDHSA-N -HMDB0045768 942.861541391 TG(20:0/20:1(11Z)/18:1(11Z)) C61H114O6 GOUXXLWMYYBHCM-BQAVMZEMSA-N -HMDB0045769 942.861541391 TG(20:0/20:1(11Z)/18:1(9Z)) C61H114O6 TZJRCHMRWDMDSJ-XQXNXHJYSA-N -HMDB0045771 966.861541391 TG(20:0/20:1(11Z)/20:3(5Z,8Z,11Z)) C63H114O6 RONZIXSUBRLVHU-NLUMJYANSA-N -HMDB0045774 940.845891326 TG(20:0/20:1(11Z)/18:2(9Z,12Z)) C61H112O6 FBQQXRDCPOBIQG-FQNAFWLOSA-N -HMDB0045775 938.830241262 TG(20:0/20:1(11Z)/18:3(6Z,9Z,12Z)) C61H110O6 IRPLNLXEUHFALC-FPAGBCFASA-N -HMDB0045776 968.877191455 TG(20:0/20:1(11Z)/20:2n6) C63H116O6 IBYMEWUNOCTTRG-RFPMTUJLSA-N -HMDB0045777 966.861541391 TG(20:0/20:1(11Z)/20:3n6) C63H114O6 JXVMBJGBROTCFP-AIMUIAEOSA-N -HMDB0045782 938.830241262 TG(20:0/20:1(11Z)/18:3(9Z,12Z,15Z)) C61H110O6 GYBHIADXUHHABV-PWKHAILISA-N -HMDB0045784 964.845891326 TG(20:0/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H112O6 JCKZVXSFNAILPO-YCFXLCDASA-N -HMDB0045785 962.830241262 TG(20:0/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 IULQMBPZWYNZEZ-KZPSUCHSSA-N -HMDB0045789 968.877191444 TG(20:0/20:3(5Z,8Z,11Z)/20:0) C63H116O6 PVLPTPLTYBYKPQ-CIBUDVKLSA-N -HMDB0045792 882.767641004 TG(20:0/20:3(5Z,8Z,11Z)/14:1(9Z)) C57H102O6 IQHVYGKMAJFIAG-UDNSWGMWSA-N -HMDB0045794 938.830241262 TG(20:0/20:3(5Z,8Z,11Z)/18:1(11Z)) C61H110O6 SNADIPNNRGNXJQ-LDZBZALLSA-N -HMDB0045795 938.830241262 TG(20:0/20:3(5Z,8Z,11Z)/18:1(9Z)) C61H110O6 UBKZOPGBBSBRBG-YBYPFBBNSA-N -HMDB0045796 966.861541391 TG(20:0/20:3(5Z,8Z,11Z)/20:1(11Z)) C63H114O6 PTBZUJYXYHDLML-MRMDCCRFSA-N -HMDB0045797 962.830241262 TG(20:0/20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)) C63H110O6 OUVCXSDTWMPGJT-VJGZYCBRSA-N -HMDB0045802 964.845891326 TG(20:0/20:3(5Z,8Z,11Z)/20:2n6) C63H112O6 KJJSZLIZMYZLOM-MPDWUWBESA-N -HMDB0045803 962.830241262 TG(20:0/20:3(5Z,8Z,11Z)/20:3n6) C63H110O6 DIKJEMPGNQDBCI-QANQIHCHSA-N -HMDB0045811 958.798941133 TG(20:0/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 USSQANBAQNQTNC-MFLWDYDXSA-N -HMDB0045814 926.866626771 TG(20:0/20:3(5Z,8Z,11Z)/o-18:0) C61H114O5 IIYQJRSPWUCSDM-WBDMOENVSA-N -HMDB0045818 914.830241262 TG(20:0/22:1(13Z)/14:1(9Z)) C59H110O6 SLVVTLNMFWVJDL-HYQPEPIUSA-N -HMDB0045819 942.861541391 TG(20:0/22:1(13Z)/16:1(9Z)) C61H114O6 LNRRWLSKAQDUBR-GDBZVGQESA-N -HMDB0045820 970.89284152 TG(20:0/22:1(13Z)/18:1(11Z)) C63H118O6 LDNPYIZUVHLDLV-YKBWBIOFSA-N -HMDB0045821 970.89284152 TG(20:0/22:1(13Z)/18:1(9Z)) C63H118O6 FOOGDTKNQFZILE-ICJFQMIVSA-N -HMDB0045826 968.877191455 TG(20:0/22:1(13Z)/18:2(9Z,12Z)) C63H116O6 SBRSQEIFWNUOMV-LIPCYRNNSA-N -HMDB0045827 966.861541391 TG(20:0/22:1(13Z)/18:3(6Z,9Z,12Z)) C63H114O6 RRCHFUDCOMJONU-SFBWWLFMSA-N -HMDB0045834 966.861541391 TG(20:0/22:1(13Z)/18:3(9Z,12Z,15Z)) C63H114O6 SFWGKPGCJSVXCM-HWMIBPLFSA-N -HMDB0045835 964.845891326 TG(20:0/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C63H112O6 ZVAZRCNQDGGHIY-LRVAFUCOSA-N -HMDB0045840 958.929227028 TG(20:0/22:1(13Z)/o-18:0) C63H122O5 CLLQMHIUPLJSCO-NYRYLARASA-N -HMDB0045844 942.861541391 TG(20:0/24:1(15Z)/14:1(9Z)) C61H114O6 ALNNHOFYSWAINZ-VGBMWCSKSA-N -HMDB0045845 970.89284152 TG(20:0/24:1(15Z)/16:1(9Z)) C63H118O6 DIWDNTROQQFMKS-OUQKOPBSSA-N -HMDB0045867 942.861541391 TG(20:0/18:2(9Z,12Z)/20:0) C61H114O6 CGYUWASKRWCFSH-GQHREOFGSA-N -HMDB0045868 970.89284152 TG(20:0/18:2(9Z,12Z)/22:0) C63H118O6 OEZPDJIPJQTNAB-NICHQRLMSA-N -HMDB0045870 856.75199094 TG(20:0/18:2(9Z,12Z)/14:1(9Z)) C55H100O6 SESIDPZYQNXGDB-MMLIVBKMSA-N -HMDB0045871 884.78329106 TG(20:0/18:2(9Z,12Z)/16:1(9Z)) C57H104O6 MSQBYCWSXAUJHK-YNTROPROSA-N -HMDB0045874 940.845891326 TG(20:0/18:2(9Z,12Z)/20:1(11Z)) C61H112O6 FHUKVTWUCRMUNV-MSTBSTCSSA-N -HMDB0045876 968.877191455 TG(20:0/18:2(9Z,12Z)/22:1(13Z)) C63H116O6 BMLXKVIKPFXMLY-BHDVDUMOSA-N -HMDB0045880 938.830241262 TG(20:0/18:2(9Z,12Z)/20:2n6) C61H110O6 UOXUZNWTFAUUEA-WFPLXBQESA-N -HMDB0045883 966.861541391 TG(20:0/18:2(9Z,12Z)/22:2(13Z,16Z)) C63H114O6 LUAVDZZOBREHQN-JBYCBOJFSA-N -HMDB0045884 962.830241262 TG(20:0/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 MYYKNWKDBLPJRV-XBEKDICWSA-N -HMDB0045891 958.798941133 TG(20:0/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 JIWBKNDEFSQJBT-OAQBWKPISA-N -HMDB0045892 900.850976706 TG(20:0/18:2(9Z,12Z)/o-18:0) C59H112O5 KUWZMMMTHHIVEK-KLWJSLDDSA-N -HMDB0045893 940.845891316 TG(20:0/18:3(6Z,9Z,12Z)/20:0) C61H112O6 JZQMWAXRJJGBMX-WROZEIRXSA-N -HMDB0045894 968.877191455 TG(20:0/18:3(6Z,9Z,12Z)/22:0) C63H116O6 ZYPBECLJEJXDCU-AQTWNSRJSA-N -HMDB0045897 882.767641004 TG(20:0/18:3(6Z,9Z,12Z)/16:1(9Z)) C57H102O6 CDDMLDFHOOIDDR-IKVHAPJZSA-N -HMDB0045900 938.830241262 TG(20:0/18:3(6Z,9Z,12Z)/20:1(11Z)) C61H110O6 VCXHGFGBKAVNAO-DMIGSALDSA-N -HMDB0045902 966.861541391 TG(20:0/18:3(6Z,9Z,12Z)/22:1(13Z)) C63H114O6 JZMNYGXVOKIZHI-GPBWOOLGSA-N -HMDB0045909 964.845891326 TG(20:0/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C63H112O6 AXLMYDXBLLUOLF-VGYLXPOGSA-N -HMDB0045911 958.798941133 TG(20:0/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 HHWHJJSODCDUKU-RAFXBCCRSA-N -HMDB0045916 958.798941133 TG(20:0/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 BFPUBWJKTOCMTE-UNFRKOAOSA-N -HMDB0045917 956.783291069 TG(20:0/18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 FKRMVRADOUUIPO-BEJNYGOSSA-N -HMDB0045919 970.89284152 TG(20:0/20:2n6/20:0) C63H118O6 IBEVRNHIOSXUJJ-QYIMKBBWSA-N -HMDB0045922 884.783291069 TG(20:0/20:2n6/14:1(9Z)) C57H104O6 SNGHDWHBYJYQOD-MERPXKMWSA-N -HMDB0045924 940.845891326 TG(20:0/20:2n6/18:1(11Z)) C61H112O6 MGIUZRTVYUQICM-HNMAWCJTSA-N -HMDB0045925 940.845891326 TG(20:0/20:2n6/18:1(9Z)) C61H112O6 MZHAAEGBTAPSRS-CSLDUXSGSA-N -HMDB0045926 968.877191455 TG(20:0/20:2n6/20:1(11Z)) C63H116O6 IPHBLBUBXCJBLT-KMNGGDODSA-N -HMDB0045927 964.845891326 TG(20:0/20:2n6/20:3(5Z,8Z,11Z)) C63H112O6 BTSUUUCAWHHMAG-DPRBZWBHSA-N -HMDB0045930 938.830241262 TG(20:0/20:2n6/18:2(9Z,12Z)) C61H110O6 SKWZGEDXJHKPTI-XLLOAUBSSA-N -HMDB0045932 966.861541391 TG(20:0/20:2n6/20:2n6) C63H114O6 GPIFUYLJOSZBCL-HTVZBKGESA-N -HMDB0045933 964.845891326 TG(20:0/20:2n6/20:3n6) C63H112O6 DTHQVLKUDRJNSH-NXEMOPDZSA-N -HMDB0045934 962.830241262 TG(20:0/20:2n6/20:4(5Z,8Z,11Z,14Z)) C63H110O6 CQJJJRSFXVFAMI-NSTNRODUSA-N -HMDB0045940 962.830241262 TG(20:0/20:2n6/20:4(8Z,11Z,14Z,17Z)) C63H110O6 NFLOZGHSXUQYSV-KQNQSDKTSA-N -HMDB0045944 928.882276835 TG(20:0/20:2n6/o-18:0) C61H116O5 SSWFQDYDESJLBB-LSMSGGNSSA-N -HMDB0045945 968.877191444 TG(20:0/20:3n6/20:0) C63H116O6 WHPQOGDRBOSGRN-BXDHOHHHSA-N -HMDB0045948 882.767641004 TG(20:0/20:3n6/14:1(9Z)) C57H102O6 RIYWVWTTXYWHMA-ZGQSWRPTSA-N -HMDB0045950 938.830241262 TG(20:0/20:3n6/18:1(11Z)) C61H110O6 FVMACQWBKCZBMW-ZVXIZCQFSA-N -HMDB0045951 938.830241262 TG(20:0/20:3n6/18:1(9Z)) C61H110O6 LKEZCTFABVCKSM-KZFKNQCPSA-N -HMDB0045952 966.861541391 TG(20:0/20:3n6/20:1(11Z)) C63H114O6 HHBLSXUEUXTLMG-KUAATXCESA-N -HMDB0045953 962.830241262 TG(20:0/20:3n6/20:3(5Z,8Z,11Z)) C63H110O6 ZYOOKRFWFUJQTP-ULCJBQRKSA-N -HMDB0045958 964.845891326 TG(20:0/20:3n6/20:2n6) C63H112O6 UCBIXYZFPRNBNY-CTNQNIPZSA-N -HMDB0045959 962.830241262 TG(20:0/20:3n6/20:3n6) C63H110O6 KRGKEXOYBMAEQS-UWCJCWLGSA-N -HMDB0045967 958.798941133 TG(20:0/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 DEGARZFHWKYSKY-QTOSBFDXSA-N -HMDB0045970 926.866626771 TG(20:0/20:3n6/o-18:0) C61H114O5 XHJNGKVAWYWMEF-GZVBRPQDSA-N -HMDB0045971 966.86154138 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:0) C63H114O6 MUIBFWWHJKHTDU-KIEMYMGWSA-N -HMDB0045974 880.75199094 TG(20:0/20:4(5Z,8Z,11Z,14Z)/14:1(9Z)) C57H100O6 ZTJPQTLPMOYUAV-OXAINDMCSA-N -HMDB0045978 964.845891326 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:1(11Z)) C63H112O6 COPQYDANMKTRTJ-MMKHNJGRSA-N -HMDB0045984 962.830241262 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:2n6) C63H110O6 QHKBTFROAVQQIT-GZXVBDGESA-N -HMDB0045992 958.798941133 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 AYHWSRWXZGTAJR-WUBDYHLFSA-N -HMDB0045993 956.783291069 TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 NPDFCHHIYFJVGQ-AVKTVSHKSA-N -HMDB0045996 924.850976706 TG(20:0/20:4(5Z,8Z,11Z,14Z)/o-18:0) C61H112O5 XDOAVAFFHWQIBZ-RFGSMKNJSA-N -HMDB0046001 940.845891326 TG(20:0/22:2(13Z,16Z)/16:1(9Z)) C61H112O6 MXJKXYIXCLMTJO-RGVXWQHYSA-N -HMDB0046002 968.877191455 TG(20:0/22:2(13Z,16Z)/18:1(11Z)) C63H116O6 ZTFSXTDCVHSWOS-AJSIEYOUSA-N -HMDB0046003 968.877191455 TG(20:0/22:2(13Z,16Z)/18:1(9Z)) C63H116O6 JLVBPNSIUBYKIC-JMGAOAHESA-N -HMDB0046008 966.861541391 TG(20:0/22:2(13Z,16Z)/18:2(9Z,12Z)) C63H114O6 XIXBCMGXHNLMTN-MGRJRRHCSA-N -HMDB0046009 964.845891326 TG(20:0/22:2(13Z,16Z)/18:3(6Z,9Z,12Z)) C63H112O6 YNIZWWNPCWHUTQ-GGMHQFBZSA-N -HMDB0046016 964.845891326 TG(20:0/22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C63H112O6 OUDWFYHOJFIKDR-QUDRZTQTSA-N -HMDB0046017 962.830241262 TG(20:0/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 JBFKNCWBKFPUIY-STHNRUHZSA-N -HMDB0046022 956.913576964 TG(20:0/22:2(13Z,16Z)/o-18:0) C63H120O5 IYNVHYKXELZPNC-MBBOPVOTSA-N -HMDB0046028 964.845891326 TG(20:0/22:4(7Z,10Z,13Z,16Z)/18:1(11Z)) C63H112O6 GIMZLHBKBDWKNT-NRIMDGPCSA-N -HMDB0046029 964.845891326 TG(20:0/22:4(7Z,10Z,13Z,16Z)/18:1(9Z)) C63H112O6 RFCDSMPUWNZUFI-AZWVIMOPSA-N -HMDB0046034 962.830241262 TG(20:0/22:4(7Z,10Z,13Z,16Z)/18:2(9Z,12Z)) C63H110O6 ACGHXTVLDFHATI-JJQYKMTCSA-N -HMDB0046043 958.798941133 TG(20:0/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 UJZIJWWJEILDEY-WXPCSILISA-N -HMDB0046048 952.882276835 TG(20:0/22:4(7Z,10Z,13Z,16Z)/o-18:0) C63H116O5 SFRHUFVHFRPPOS-GUBGQLFOSA-N -HMDB0046054 962.830241262 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:1(11Z)) C63H110O6 GEYBFTLZFGOMLS-UARABLDKSA-N -HMDB0046055 962.830241262 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)) C63H110O6 XIMVAXPQXRCQDC-DBBMJRQSSA-N -HMDB0046061 958.798941133 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)) C63H106O6 MOPJMQJQXVNKMM-VZZXKGMBSA-N -HMDB0046068 958.798941133 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H106O6 AMLVLGGTLWUONM-RRWYFFCASA-N -HMDB0046069 956.783291069 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 DIKFYIAWOURXLG-GORHZOPMSA-N -HMDB0046074 950.866626771 TG(20:0/22:5(4Z,7Z,10Z,13Z,16Z)/o-18:0) C63H114O5 BQXBXQMXXNQSMI-BMMDOFMQSA-N -HMDB0046075 940.845891316 TG(20:0/18:3(9Z,12Z,15Z)/20:0) C61H112O6 BBEXOEBBZPQUND-RJROPJSDSA-N -HMDB0046076 968.877191455 TG(20:0/18:3(9Z,12Z,15Z)/22:0) C63H116O6 LPFMURDWEDJXOF-MIKSAASRSA-N -HMDB0046079 882.767641004 TG(20:0/18:3(9Z,12Z,15Z)/16:1(9Z)) C57H102O6 HLTSKBNGPCVUQB-GBISFHARSA-N -HMDB0046082 938.830241262 TG(20:0/18:3(9Z,12Z,15Z)/20:1(11Z)) C61H110O6 XGCJOJLDYHICIU-VSVWVITESA-N -HMDB0046084 966.861541391 TG(20:0/18:3(9Z,12Z,15Z)/22:1(13Z)) C63H114O6 DKUNFLKMWAUNDY-XLDBSBOMSA-N -HMDB0046091 964.845891326 TG(20:0/18:3(9Z,12Z,15Z)/22:2(13Z,16Z)) C63H112O6 IGGJZLJGRRYFIM-MDNDJFNRSA-N -HMDB0046093 958.798941133 TG(20:0/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 BHRCZYGYXNQZMA-VMZQIZTASA-N -HMDB0046098 958.798941133 TG(20:0/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 ZBIXPXAIQGNOJR-CUUYKELTSA-N -HMDB0046099 956.783291069 TG(20:0/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 XIQRFKNFMFEAKD-DTNNTXARSA-N -HMDB0046101 938.830241252 TG(20:0/18:4(6Z,9Z,12Z,15Z)/20:0) C61H110O6 BPWFSTBTZXCPDN-GXWIXYFISA-N -HMDB0046102 966.861541391 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:0) C63H114O6 PPUMGRJWTDYAJJ-BCPBRTCFSA-N -HMDB0046104 852.720690811 TG(20:0/18:4(6Z,9Z,12Z,15Z)/14:1(9Z)) C55H96O6 AYBNKZOBZIRMHJ-WCCWLRMCSA-N -HMDB0046105 880.75199094 TG(20:0/18:4(6Z,9Z,12Z,15Z)/16:1(9Z)) C57H100O6 ZTNCEOWHIGXJAM-CAYPXVCWSA-N -HMDB0046110 964.845891326 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:1(13Z)) C63H112O6 QMDVGDLZLSCJAH-WAECXLMDSA-N -HMDB0046117 962.830241262 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)) C63H110O6 OIBLFFKYXAHRDW-PWDULKBFSA-N -HMDB0046118 958.798941133 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 QOVOXGFLQUWOCD-SKYIGCTFSA-N -HMDB0046119 956.783291069 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 JRUAJAMOWZTEMR-NQCJURAZSA-N -HMDB0046124 956.783291069 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 VOIUMMLAPMMRMR-FONKPBJWSA-N -HMDB0046125 954.767641004 TG(20:0/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 FUSFZXIXQUQAAT-ARAUNSSXSA-N -HMDB0046127 966.86154138 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:0) C63H114O6 ALYVJOCNZCAWSV-QWZXXBLSSA-N -HMDB0046130 880.75199094 TG(20:0/20:4(8Z,11Z,14Z,17Z)/14:1(9Z)) C57H100O6 UMZQUOZZVLDATH-FCTVMWBXSA-N -HMDB0046134 964.845891326 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:1(11Z)) C63H112O6 MVZVFFWLMVHSMR-GMQUXJIXSA-N -HMDB0046140 962.830241262 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:2n6) C63H110O6 NEVHLARDZQWNDN-ZFYLZMJQSA-N -HMDB0046142 958.798941133 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 FACDAQXMPKTFRQ-SDRVTRRESA-N -HMDB0046148 958.798941133 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 OSJAITDJSAAPCD-BJFZWASFSA-N -HMDB0046149 956.783291069 TG(20:0/20:4(8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 NTQFVICUXZMCHT-XSODUGAPSA-N -HMDB0046152 924.850976706 TG(20:0/20:4(8Z,11Z,14Z,17Z)/o-18:0) C61H112O5 VWISUFHDQBBLJZ-QHOGBMJCSA-N -HMDB0046153 964.845891316 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:0) C63H112O6 ZFWLBSAZUANAAS-PBXDZALFSA-N -HMDB0046160 962.830241262 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:1(11Z)) C63H110O6 WIMOTPNOOSOQHS-SQVGUTRSSA-N -HMDB0046161 958.798941133 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:3(5Z,8Z,11Z)) C63H106O6 GEHPSFWUFSXURT-CBDFWBFOSA-N -HMDB0046167 958.798941133 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6) C63H106O6 JUJSCXCFHLKMAG-XOZROWQMSA-N -HMDB0046168 956.783291069 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 KBDPPMIATBCOMG-IRNKZLHESA-N -HMDB0046174 956.783291069 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 HBEVIJGDUHOPDQ-IKOSZMCSSA-N -HMDB0046175 954.767641004 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 VJVMHCYTENEWNN-ZXFARNTQSA-N -HMDB0046177 980.783291069 TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 NGKSSGSZKCGACO-LLLFLALWSA-N -HMDB0046184 962.830241262 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(11Z)) C63H110O6 IFBNXRASQCUYMI-VXEJXGLMSA-N -HMDB0046185 962.830241262 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)) C63H110O6 HMRPHEFZYARYNZ-MMZAMPIZSA-N -HMDB0046191 958.798941133 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(6Z,9Z,12Z)) C63H106O6 BPDREBISDHEJBG-XPOREUEJSA-N -HMDB0046198 958.798941133 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C63H106O6 FGCRNQQTWMCHBU-OAWAPQENSA-N -HMDB0046199 956.783291069 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 PUGGWLRJISRKED-HXJIIFRWSA-N -HMDB0046204 950.866626771 TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H114O5 FXPIYBNAKLGETL-UTVLKCAYSA-N -HMDB0046216 958.798941133 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)) C63H106O6 GJTXTGACCVJFCY-WXORGEGGSA-N -HMDB0046217 956.783291069 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(6Z,9Z,12Z)) C63H104O6 JASRGXRLHMKFMV-FRAUDBJISA-N -HMDB0046224 956.783291069 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C63H104O6 IILFLPTWCQUCBF-JXJKYVJMSA-N -HMDB0046225 954.767641004 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C63H102O6 JYPCPBKGHFDBQX-DJDNCNAFSA-N -HMDB0046227 980.783291069 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H104O6 QSDDUOAVUDULFV-WFLXKTIRSA-N -HMDB0046230 948.850976706 TG(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H112O5 HLBJXGSSXOWJNK-XQIDWFEWSA-N -HMDB0046235 874.835326642 TG(20:0/o-18:0/16:1(9Z)) C57H110O5 ZRKRTZFYHUBTQQ-AYMZKUIOSA-N -HMDB0046236 902.866626771 TG(20:0/o-18:0/18:1(11Z)) C59H114O5 UKQZYMLCKHOSTG-COAUFNLESA-N -HMDB0046237 902.866626771 TG(20:0/o-18:0/18:1(9Z)) C59H114O5 MTMFSFJLPCNPOI-LKKPSHJRSA-N -HMDB0046239 926.866626771 TG(20:0/o-18:0/20:3(5Z,8Z,11Z)) C61H114O5 DPXCUHXDCAZRMD-VFADWVNGSA-N -HMDB0046240 958.929227028 TG(20:0/o-18:0/22:1(13Z)) C63H122O5 ZIDPGXBTSKOGRO-SBOILKGHSA-N -HMDB0046242 900.850976706 TG(20:0/o-18:0/18:2(9Z,12Z)) C59H112O5 CZOALYUQVVTJLR-KLWJSLDDSA-N -HMDB0046244 928.882276835 TG(20:0/o-18:0/20:2n6) C61H116O5 ZAQWCHTYSYNWSH-UWVPRLFQSA-N -HMDB0046245 926.866626771 TG(20:0/o-18:0/20:3n6) C61H114O5 ZJDHSVUVYJSBGX-HIVQLAITSA-N -HMDB0046246 924.850976706 TG(20:0/o-18:0/20:4(5Z,8Z,11Z,14Z)) C61H112O5 FHLGAKXGDKAPGG-KBFGIVFISA-N -HMDB0046247 956.913576964 TG(20:0/o-18:0/22:2(13Z,16Z)) C63H120O5 KBOXWJNBWNAPDL-OSIVHGPASA-N -HMDB0046248 952.882276835 TG(20:0/o-18:0/22:4(7Z,10Z,13Z,16Z)) C63H116O5 OIZMVBWGKIPHII-SQJZZZAOSA-N -HMDB0046249 950.866626771 TG(20:0/o-18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H114O5 XTVWCEQQMYEOJZ-SOIYDMAESA-N -HMDB0046252 924.850976706 TG(20:0/o-18:0/20:4(8Z,11Z,14Z,17Z)) C61H112O5 VVNNBLZFSZUXRC-PNXODHRNSA-N -HMDB0046254 950.866626771 TG(20:0/o-18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H114O5 JSBGTMPZZRTBBA-BKJFYFMPSA-N -HMDB0046255 948.850976706 TG(20:0/o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H112O5 DPGIVBQTWYXEKO-FRQRDVANSA-N -HMDB0046260 888.814591198 TG(22:0/14:0/18:1(11Z)) C57H108O6 NZPQRJJPGATRLU-WTNBXCFCSA-N -HMDB0046261 888.814591198 TG(22:0/14:0/18:1(9Z)) C57H108O6 AIUFGXSNPIPWDK-RGRWSSGASA-N -HMDB0046262 916.845891326 TG(22:0/14:0/20:1(11Z)) C59H112O6 NNJOIWXHONILSA-VXVUXWGWSA-N -HMDB0046265 972.908491584 TG(22:0/14:0/24:1(15Z)) C63H120O6 HEROZXQJPBVFAZ-HFGOSKLVSA-N -HMDB0046267 884.783291069 TG(22:0/14:0/18:3(6Z,9Z,12Z)) C57H104O6 FXJPVPHYLZUPPO-KTEJGUCTSA-N -HMDB0046268 914.830241262 TG(22:0/14:0/20:2n6) C59H110O6 VCTGTMSVVLORIT-QMIHDCNESA-N -HMDB0046271 942.861541391 TG(22:0/14:0/22:2(13Z,16Z)) C61H114O6 NDIASEVRLBWVRO-MEADVOAOSA-N -HMDB0046272 938.830241262 TG(22:0/14:0/22:4(7Z,10Z,13Z,16Z)) C61H110O6 HMVLLJGZOCQDFI-LIOPWZIDSA-N -HMDB0046274 884.783291069 TG(22:0/14:0/18:3(9Z,12Z,15Z)) C57H104O6 LKMMURDMXJRDKU-SZZNRBPJSA-N -HMDB0046275 882.767641004 TG(22:0/14:0/18:4(6Z,9Z,12Z,15Z)) C57H102O6 WFAJQYLYYSZBCZ-NJNIVTQZSA-N -HMDB0046292 898.798941133 TG(22:0/15:0/18:3(6Z,9Z,12Z)) C58H106O6 YTPRVRWPVFSOAL-MHPADUKNSA-N -HMDB0046299 898.798941133 TG(22:0/15:0/18:3(9Z,12Z,15Z)) C58H106O6 YFTFKGRPESIBQI-FNRWURKDSA-N -HMDB0046300 896.783291069 TG(22:0/15:0/18:4(6Z,9Z,12Z,15Z)) C58H104O6 ZSRZPVOHGXEPMJ-JYUNQQGZSA-N -HMDB0046309 888.814591198 TG(22:0/16:0/16:1(9Z)) C57H108O6 YKCVKNPTWXLRMR-WTNBXCFCSA-N -HMDB0046310 916.845891326 TG(22:0/16:0/18:1(11Z)) C59H112O6 LJWFWKJSUKWNCH-BUKBLQRKSA-N -HMDB0046311 916.845891326 TG(22:0/16:0/18:1(9Z)) C59H112O6 DNKJHSCCXVKXSU-VOLVXKCUSA-N -HMDB0046313 940.845891326 TG(22:0/16:0/20:3(5Z,8Z,11Z)) C61H112O6 XAXCHZWOFLFLPM-JOQVWQIOSA-N -HMDB0046314 972.908491584 TG(22:0/16:0/22:1(13Z)) C63H120O6 LHPFBXJMLHBPAN-NQFAIHCZSA-N -HMDB0046316 914.830241262 TG(22:0/16:0/18:2(9Z,12Z)) C59H110O6 MIWODFZGWMDPCD-GJDNKMPCSA-N -HMDB0046318 942.861541391 TG(22:0/16:0/20:2n6) C61H114O6 LVHNDABSHOYKAM-KZBHDBQSSA-N -HMDB0046319 940.845891326 TG(22:0/16:0/20:3n6) C61H112O6 QANJMRAWHCWEGS-WVTAUSKUSA-N -HMDB0046320 938.830241262 TG(22:0/16:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 VDFBIEOSCQDYJB-JSSUDYGASA-N -HMDB0046321 970.89284152 TG(22:0/16:0/22:2(13Z,16Z)) C63H118O6 RTYVZERQRRRYNE-FREZPLNNSA-N -HMDB0046322 966.861541391 TG(22:0/16:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 CYEYMUIZHDCNEQ-OCRKRECJSA-N -HMDB0046323 964.845891326 TG(22:0/16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 LOUYJPLUAGKBFG-OVRZQIFDSA-N -HMDB0046326 938.830241262 TG(22:0/16:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 OWZRRACHZQKQKB-BVJSQKDDSA-N -HMDB0046328 964.845891326 TG(22:0/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 YXFXBGQKOCWXIW-SHFIIMMASA-N -HMDB0046329 962.830241262 TG(22:0/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 PSQNMLIGVNKGBS-QCRPGBDUSA-N -HMDB0046333 888.814591198 TG(22:0/18:0/14:1(9Z)) C57H108O6 VPROCYYUGRMDKB-IXHOOSMISA-N -HMDB0046334 916.845891326 TG(22:0/18:0/16:1(9Z)) C59H112O6 PLFFUZALKUXPFW-SZPKOVDMSA-N -HMDB0046337 972.908491584 TG(22:0/18:0/20:1(11Z)) C63H120O6 RDDJZUXEKOBRLD-MXRIWFMKSA-N -HMDB0046338 968.877191455 TG(22:0/18:0/20:3(5Z,8Z,11Z)) C63H116O6 SSQXIJLQGIDAIS-JYULCUDISA-N -HMDB0046341 942.861541391 TG(22:0/18:0/18:2(9Z,12Z)) C61H114O6 ZJYWYCGVUDBWGE-VSQDVKCVSA-N -HMDB0046342 940.845891326 TG(22:0/18:0/18:3(6Z,9Z,12Z)) C61H112O6 NGDYFTHZYYRYJI-VNYALLQPSA-N -HMDB0046343 970.89284152 TG(22:0/18:0/20:2n6) C63H118O6 CUYWPWQOJRQSCW-QSDYZZDBSA-N -HMDB0046344 968.877191455 TG(22:0/18:0/20:3n6) C63H116O6 IJOXAPFYWITIHW-JPDDOHNZSA-N -HMDB0046345 966.861541391 TG(22:0/18:0/20:4(5Z,8Z,11Z,14Z)) C63H114O6 JUAQGNVWXOALQO-DNANJBHKSA-N -HMDB0046349 940.845891326 TG(22:0/18:0/18:3(9Z,12Z,15Z)) C61H112O6 PEDXBSVTVPVYSP-HGUYPXMVSA-N -HMDB0046350 938.830241262 TG(22:0/18:0/18:4(6Z,9Z,12Z,15Z)) C61H110O6 NEHKBJPTASJPGS-RMFNYSRHSA-N -HMDB0046351 966.861541391 TG(22:0/18:0/20:4(8Z,11Z,14Z,17Z)) C63H114O6 WAWGLAWANXTROF-ZZMAYMJNSA-N -HMDB0046352 964.845891326 TG(22:0/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O6 LFKOJNRPJDKRCS-BCSLLQQQSA-N -HMDB0046358 916.845891326 TG(22:0/20:0/14:1(9Z)) C59H112O6 ODHWPZFGXIMZRL-AAABZKSKSA-N -HMDB0046360 972.908491584 TG(22:0/20:0/18:1(11Z)) C63H120O6 MFTJGJJGQONILX-RXNSVRMPSA-N -HMDB0046361 972.908491584 TG(22:0/20:0/18:1(9Z)) C63H120O6 QMGVAYGHMZTSEF-YAOUCAOSSA-N -HMDB0046366 970.89284152 TG(22:0/20:0/18:2(9Z,12Z)) C63H118O6 PXBQCSMXBDELKI-GZBHRQIQSA-N -HMDB0046367 968.877191455 TG(22:0/20:0/18:3(6Z,9Z,12Z)) C63H116O6 SRFZZMHOMJJKRR-RKJQRDPNSA-N -HMDB0046374 968.877191455 TG(22:0/20:0/18:3(9Z,12Z,15Z)) C63H116O6 JJWIHFDQAUJTKM-SRUIGVKTSA-N -HMDB0046375 966.861541391 TG(22:0/20:0/18:4(6Z,9Z,12Z,15Z)) C63H114O6 LAYMMGQEJTZXHH-LHFRGBNGSA-N -HMDB0046384 972.908491584 TG(22:0/22:0/16:1(9Z)) C63H120O6 JRIJXKUOTQILAX-RXNSVRMPSA-N -HMDB0046408 972.908491584 TG(22:0/24:0/14:1(9Z)) C63H120O6 JJHAIYBALUXLAQ-UMYTVORISA-N -HMDB0046432 972.908491584 TG(22:0/14:1(9Z)/24:0) C63H120O6 NIPVPXGEDBBOMK-XTKDRUTHSA-N -HMDB0046437 914.830241262 TG(22:0/14:1(9Z)/20:1(11Z)) C59H110O6 WIJRMMMSSQJMCO-OHQKQAFOSA-N -HMDB0046439 942.861541391 TG(22:0/14:1(9Z)/22:1(13Z)) C61H114O6 PWCZEZSCMQVPJQ-VGBMWCSKSA-N -HMDB0046440 970.89284152 TG(22:0/14:1(9Z)/24:1(15Z)) C63H118O6 MEEQUTNYZOELIE-BHTARXBPSA-N -HMDB0046441 884.783291069 TG(22:0/14:1(9Z)/18:2(9Z,12Z)) C57H104O6 VZQSJRZRVOMAEX-NTJLCKQPSA-N -HMDB0046442 882.767641004 TG(22:0/14:1(9Z)/18:3(6Z,9Z,12Z)) C57H102O6 NQZWUGZPCSPJEX-LRRPHUEISA-N -HMDB0046446 940.845891326 TG(22:0/14:1(9Z)/22:2(13Z,16Z)) C61H112O6 KJGHSPINRPPFIW-IBENIOHQSA-N -HMDB0046449 882.767641004 TG(22:0/14:1(9Z)/18:3(9Z,12Z,15Z)) C57H102O6 OYMKHLWGIUBLIM-ROXUKPIWSA-N -HMDB0046450 880.75199094 TG(22:0/14:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C57H100O6 UNKHDPXDHSBDOZ-BXAJSTJNSA-N -HMDB0046455 874.83532663 TG(22:0/14:1(9Z)/o-18:0) C57H110O5 BDPJRENIZGEJEP-SDXDJHTJSA-N -HMDB0046456 972.908491572 TG(22:0/16:1(9Z)/22:0) C63H120O6 RWKYSZZMYDKMMP-FLFQWRMESA-N -HMDB0046460 914.830241262 TG(22:0/16:1(9Z)/18:1(11Z)) C59H110O6 GJZLKYUSHJORNQ-ZLUYPCRLSA-N -HMDB0046461 914.830241262 TG(22:0/16:1(9Z)/18:1(9Z)) C59H110O6 CQGCPQNAYLDVOH-GIEBDLEXSA-N -HMDB0046462 942.861541391 TG(22:0/16:1(9Z)/20:1(11Z)) C61H114O6 JEEMXKLREVCFGB-ORAGRNPGSA-N -HMDB0046463 938.830241262 TG(22:0/16:1(9Z)/20:3(5Z,8Z,11Z)) C61H110O6 WOHMUGVGZMEZQE-ZJVQMEQSSA-N -HMDB0046464 970.89284152 TG(22:0/16:1(9Z)/22:1(13Z)) C63H118O6 XOPFKAUVUXZXGV-OUQKOPBSSA-N -HMDB0046468 940.845891326 TG(22:0/16:1(9Z)/20:2n6) C61H112O6 NGGZABQJVQPRCU-JFMOTOFNSA-N -HMDB0046469 938.830241262 TG(22:0/16:1(9Z)/20:3n6) C61H110O6 PTOBJPAOCFDZJO-IQNNNQAJSA-N -HMDB0046471 968.877191455 TG(22:0/16:1(9Z)/22:2(13Z,16Z)) C63H116O6 ZUIIFSXSZSIBCK-IURLQLJKSA-N -HMDB0046472 964.845891326 TG(22:0/16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 UNUYEOWBNOUCHI-RLYBGMALSA-N -HMDB0046473 962.830241262 TG(22:0/16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 REOIMVZEISKUHF-SHKLLSLUSA-N -HMDB0046478 962.830241262 TG(22:0/16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 LGMIHDFKAMFZFO-BVDYWXALSA-N -HMDB0046480 902.866626771 TG(22:0/16:1(9Z)/o-18:0) C59H114O5 LFLULLQVQPKAMK-COAUFNLESA-N -HMDB0046484 914.830241262 TG(22:0/18:1(11Z)/16:1(9Z)) C59H110O6 JTMVEGQXRXTDQX-ZLUYPCRLSA-N -HMDB0046485 942.861541391 TG(22:0/18:1(11Z)/18:1(11Z)) C61H114O6 CDMARTCICGPDST-GMFCVOFDSA-N -HMDB0046486 942.861541391 TG(22:0/18:1(11Z)/18:1(9Z)) C61H114O6 YHILGYSICPKXAA-HAQNTTHJSA-N -HMDB0046487 970.89284152 TG(22:0/18:1(11Z)/20:1(11Z)) C63H118O6 WTCMNORLXBIXAX-NYLLBKPFSA-N -HMDB0046488 966.861541391 TG(22:0/18:1(11Z)/20:3(5Z,8Z,11Z)) C63H114O6 HOOIWTKANHPAOR-WFCJKOETSA-N -HMDB0046491 940.845891326 TG(22:0/18:1(11Z)/18:2(9Z,12Z)) C61H112O6 IIJVLTDWMAWLFO-IUDYXZLCSA-N -HMDB0046492 938.830241262 TG(22:0/18:1(11Z)/18:3(6Z,9Z,12Z)) C61H110O6 UDIKHJQTLDFGFW-LEVMJDGGSA-N -HMDB0046493 968.877191455 TG(22:0/18:1(11Z)/20:2n6) C63H116O6 GBUWYEPDQKOYKY-HQMLJKSRSA-N -HMDB0046494 966.861541391 TG(22:0/18:1(11Z)/20:3n6) C63H114O6 INCHZKMNHLHTMY-NVYNFKEVSA-N -HMDB0046495 964.845891326 TG(22:0/18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H112O6 NBAGACYNMBHBAX-UCIKURBBSA-N -HMDB0046499 938.830241262 TG(22:0/18:1(11Z)/18:3(9Z,12Z,15Z)) C61H110O6 RFWZFNZBJZHWEA-VKCGIOIVSA-N -HMDB0046501 964.845891326 TG(22:0/18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H112O6 JMEDNPXWSUSBMW-JWCUFUJSSA-N -HMDB0046502 962.830241262 TG(22:0/18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 ZGKZBSSBZQXPKF-MTDAWVPLSA-N -HMDB0046509 914.830241252 TG(22:0/18:1(9Z)/16:1(9Z)) C59H110O6 LLZPZRGVBKFBKR-GIEBDLEXSA-N -HMDB0046510 942.861541391 TG(22:0/18:1(9Z)/18:1(11Z)) C61H114O6 FTFVPUBFVDVJAU-NJSMUVRASA-N -HMDB0046511 942.86154138 TG(22:0/18:1(9Z)/18:1(9Z)) C61H114O6 MAWRDGRSFXIWKV-PVNZSUHJSA-N -HMDB0046512 970.89284152 TG(22:0/18:1(9Z)/20:1(11Z)) C63H118O6 SLCSZUMZGXHZBR-QSGKUKMWSA-N -HMDB0046513 966.861541391 TG(22:0/18:1(9Z)/20:3(5Z,8Z,11Z)) C63H114O6 QQXNBQNXQFZRPW-JKNRJROESA-N -HMDB0046516 940.845891326 TG(22:0/18:1(9Z)/18:2(9Z,12Z)) C61H112O6 AMDSHUSILZVWMX-NSOUBCFQSA-N -HMDB0046517 938.830241262 TG(22:0/18:1(9Z)/18:3(6Z,9Z,12Z)) C61H110O6 OUGBFDBXTPQOJV-XAHZAFGXSA-N -HMDB0046518 968.877191455 TG(22:0/18:1(9Z)/20:2n6) C63H116O6 QYYNNMGUOXLSIN-IIFQMVJHSA-N -HMDB0046519 966.861541391 TG(22:0/18:1(9Z)/20:3n6) C63H114O6 QFXWHSAPDFXYOG-HPPVFJRISA-N -HMDB0046520 964.845891326 TG(22:0/18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C63H112O6 YFHMHPUWCPHBQO-RXTVTRGASA-N -HMDB0046524 938.830241262 TG(22:0/18:1(9Z)/18:3(9Z,12Z,15Z)) C61H110O6 HNLMGPXMNLVNRF-NVQONJOPSA-N -HMDB0046526 964.845891326 TG(22:0/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C63H112O6 CZMBTAPVPVKAEQ-LJDQVSKQSA-N -HMDB0046527 962.830241262 TG(22:0/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 ICZNVYWIBUJKRO-KXDVIGTRSA-N -HMDB0046533 914.830241262 TG(22:0/20:1(11Z)/14:1(9Z)) C59H110O6 HZTVWEWLCFVURZ-OHQKQAFOSA-N -HMDB0046534 942.861541391 TG(22:0/20:1(11Z)/16:1(9Z)) C61H114O6 PKPAOZPHGVIQGC-ORAGRNPGSA-N -HMDB0046535 970.89284152 TG(22:0/20:1(11Z)/18:1(11Z)) C63H118O6 CFOWRVBCJCEHTO-NYLLBKPFSA-N -HMDB0046536 970.89284152 TG(22:0/20:1(11Z)/18:1(9Z)) C63H118O6 SEOQXFHPWMVJJP-QSGKUKMWSA-N -HMDB0046541 968.877191455 TG(22:0/20:1(11Z)/18:2(9Z,12Z)) C63H116O6 LEZBCWXJJZZACU-NYUYSZTLSA-N -HMDB0046542 966.861541391 TG(22:0/20:1(11Z)/18:3(6Z,9Z,12Z)) C63H114O6 BJOKYLJMABAHNL-RGDGXKHXSA-N -HMDB0046549 966.861541391 TG(22:0/20:1(11Z)/18:3(9Z,12Z,15Z)) C63H114O6 YWQYUQPMOLYBJW-ROPUVPJDSA-N -HMDB0046550 964.845891326 TG(22:0/20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C63H112O6 TUZZBILRHPBTHW-XUBHAFIFSA-N -HMDB0046555 958.929227028 TG(22:0/20:1(11Z)/o-18:0) C63H122O5 XFSRNVJYWCLUGE-SFTFLQKMSA-N -HMDB0046559 938.830241262 TG(22:0/20:3(5Z,8Z,11Z)/16:1(9Z)) C61H110O6 LWKAZICCJBIXBG-PYGGNLRSSA-N -HMDB0046560 966.861541391 TG(22:0/20:3(5Z,8Z,11Z)/18:1(11Z)) C63H114O6 GKSQQYCZRSBFKG-DOAJSNOHSA-N -HMDB0046561 966.861541391 TG(22:0/20:3(5Z,8Z,11Z)/18:1(9Z)) C63H114O6 BGIMVPIMTCDTIR-NJOYNODISA-N -HMDB0046566 964.845891326 TG(22:0/20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C63H112O6 XGXUDWBHHLLXEY-KESZXVECSA-N -HMDB0046567 962.830241262 TG(22:0/20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)) C63H110O6 OHGHFOMCCWAMGO-GGUDGPTISA-N -HMDB0046574 962.830241262 TG(22:0/20:3(5Z,8Z,11Z)/18:3(9Z,12Z,15Z)) C63H110O6 COTBIHOOVUEBLQ-GPDRFHHZSA-N -HMDB0046580 954.8979269 TG(22:0/20:3(5Z,8Z,11Z)/o-18:0) C63H118O5 PLJUCVWMUHTXMN-UVXDFRCHSA-N -HMDB0046583 942.861541391 TG(22:0/22:1(13Z)/14:1(9Z)) C61H114O6 ZUYMTPHHKSWXII-XCYFVEGBSA-N -HMDB0046584 970.89284152 TG(22:0/22:1(13Z)/16:1(9Z)) C63H118O6 UHIRVISANDDFQO-MOBNGOAYSA-N -HMDB0046608 970.89284152 TG(22:0/24:1(15Z)/14:1(9Z)) C63H118O6 KDBXLBUVLNGKSH-ITNNUTPKSA-N -HMDB0046633 884.783291069 TG(22:0/18:2(9Z,12Z)/14:1(9Z)) C57H104O6 FYOAFNBAIZJVFT-NTJLCKQPSA-N -HMDB0046635 940.845891326 TG(22:0/18:2(9Z,12Z)/18:1(11Z)) C61H112O6 BVJWKPOODLDRIT-PEABHCIMSA-N -HMDB0046636 940.845891326 TG(22:0/18:2(9Z,12Z)/18:1(9Z)) C61H112O6 POBQACNRSDFLSN-KWNVGJMZSA-N -HMDB0046637 968.877191455 TG(22:0/18:2(9Z,12Z)/20:1(11Z)) C63H116O6 CYNDYCIRXVVTMS-NYUYSZTLSA-N -HMDB0046638 964.845891326 TG(22:0/18:2(9Z,12Z)/20:3(5Z,8Z,11Z)) C63H112O6 RNCIUDLIXBXAFK-OHUBGVLXSA-N -HMDB0046641 938.830241262 TG(22:0/18:2(9Z,12Z)/18:2(9Z,12Z)) C61H110O6 OEWUGNNMLZAOCV-HESLGCGWSA-N -HMDB0046643 966.861541391 TG(22:0/18:2(9Z,12Z)/20:2n6) C63H114O6 JCOSJHHIEGDUHK-WPTUVLMGSA-N -HMDB0046644 964.845891326 TG(22:0/18:2(9Z,12Z)/20:3n6) C63H112O6 FOFFTNBYEWWFON-GXOGTJNASA-N -HMDB0046645 962.830241262 TG(22:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 WLCMTXXFZMOMHZ-HCQIXYHGSA-N -HMDB0046651 962.830241262 TG(22:0/18:2(9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 NUARLQSDFGRENY-DPBDSRLRSA-N -HMDB0046655 928.882276835 TG(22:0/18:2(9Z,12Z)/o-18:0) C61H116O5 GVNOVHPRZPBICJ-FMZYJFPSSA-N -HMDB0046658 882.767641004 TG(22:0/18:3(6Z,9Z,12Z)/14:1(9Z)) C57H102O6 OOXHPYMTHPKODA-FGMJLWFOSA-N -HMDB0046660 938.830241262 TG(22:0/18:3(6Z,9Z,12Z)/18:1(11Z)) C61H110O6 IGCFSFMLNPLXMG-DCQATEPYSA-N -HMDB0046661 938.830241262 TG(22:0/18:3(6Z,9Z,12Z)/18:1(9Z)) C61H110O6 IBFKGUJFNGJJRX-AOCQWRAGSA-N -HMDB0046662 966.861541391 TG(22:0/18:3(6Z,9Z,12Z)/20:1(11Z)) C63H114O6 PEOBDAPKUYNJDB-MYOXEBKRSA-N -HMDB0046663 962.830241262 TG(22:0/18:3(6Z,9Z,12Z)/20:3(5Z,8Z,11Z)) C63H110O6 UYRLXLPLLFAUHZ-PLJKHQMYSA-N -HMDB0046668 964.845891326 TG(22:0/18:3(6Z,9Z,12Z)/20:2n6) C63H112O6 FEJZLHABNKUOEC-OZGNECFISA-N -HMDB0046669 962.830241262 TG(22:0/18:3(6Z,9Z,12Z)/20:3n6) C63H110O6 LABYNSUZQGFKHQ-YKIUAFIRSA-N -HMDB0046677 958.798941133 TG(22:0/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 MPNBJXUQYBYLAM-ZFVYTVGJSA-N -HMDB0046680 926.866626771 TG(22:0/18:3(6Z,9Z,12Z)/o-18:0) C61H114O5 USAFSLJNOZHCHX-OLDLFXAKSA-N -HMDB0046684 940.845891326 TG(22:0/20:2n6/16:1(9Z)) C61H112O6 UMZMGYWVBWXWDT-JFMOTOFNSA-N -HMDB0046685 968.877191455 TG(22:0/20:2n6/18:1(11Z)) C63H116O6 ZDIISHVVPLAVCQ-HQMLJKSRSA-N -HMDB0046686 968.877191455 TG(22:0/20:2n6/18:1(9Z)) C63H116O6 JQGCOHUTHPKJNA-IIFQMVJHSA-N -HMDB0046691 966.861541391 TG(22:0/20:2n6/18:2(9Z,12Z)) C63H114O6 DZABKADJKVACIK-WPTUVLMGSA-N -HMDB0046692 964.845891326 TG(22:0/20:2n6/18:3(6Z,9Z,12Z)) C63H112O6 PPOURTVWTVHRMU-PWFFWLJSSA-N -HMDB0046699 964.845891326 TG(22:0/20:2n6/18:3(9Z,12Z,15Z)) C63H112O6 HRJKHHJODKNNJK-QZHYZABFSA-N -HMDB0046700 962.830241262 TG(22:0/20:2n6/18:4(6Z,9Z,12Z,15Z)) C63H110O6 QIGRMYCCQMEGIU-GRCDQXJASA-N -HMDB0046705 956.913576964 TG(22:0/20:2n6/o-18:0) C63H120O5 NJFXQBUHWRCFMV-YAGAPKITSA-N -HMDB0046709 938.830241262 TG(22:0/20:3n6/16:1(9Z)) C61H110O6 RETPNLDNHGHCKP-MVRAHNBMSA-N -HMDB0046710 966.861541391 TG(22:0/20:3n6/18:1(11Z)) C63H114O6 MIDOZDIGHHQOQX-FNHXGNCZSA-N -HMDB0046711 966.861541391 TG(22:0/20:3n6/18:1(9Z)) C63H114O6 GDSOHLLQXYEIDF-NJEFQXLBSA-N -HMDB0046716 964.845891326 TG(22:0/20:3n6/18:2(9Z,12Z)) C63H112O6 FRWFMVSCXNKUPX-UMPIFXHYSA-N -HMDB0046717 962.830241262 TG(22:0/20:3n6/18:3(6Z,9Z,12Z)) C63H110O6 NZPQLKPAJMTADW-KXCXIZSASA-N -HMDB0046724 962.830241262 TG(22:0/20:3n6/18:3(9Z,12Z,15Z)) C63H110O6 YOUSHAZSTHBEJI-HIUQRNKPSA-N -HMDB0046730 954.8979269 TG(22:0/20:3n6/o-18:0) C63H118O5 FATDEJIPCRXHBE-OXDZVLJVSA-N -HMDB0046735 964.845891326 TG(22:0/20:4(5Z,8Z,11Z,14Z)/18:1(11Z)) C63H112O6 MEEWQDGSGNOSQP-GEGMZPCCSA-N -HMDB0046736 964.845891326 TG(22:0/20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) C63H112O6 XTFHDFLJLDMULJ-BSBHVWGUSA-N -HMDB0046741 962.830241262 TG(22:0/20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)) C63H110O6 IKHPWHNVYZLELL-GUXUWGKWSA-N -HMDB0046750 958.798941133 TG(22:0/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 YKVDFZOAUOIXCA-LAINSVEPSA-N -HMDB0046755 952.882276835 TG(22:0/20:4(5Z,8Z,11Z,14Z)/o-18:0) C63H116O5 JDBIUXJWGUOYCR-FYOBVNDYSA-N -HMDB0046758 940.845891326 TG(22:0/22:2(13Z,16Z)/14:1(9Z)) C61H112O6 CQQRPMOWXSEZTP-QUIYVIRQSA-N -HMDB0046759 968.877191455 TG(22:0/22:2(13Z,16Z)/16:1(9Z)) C63H116O6 WHBOQNGVRPUVKB-XQVSIXSYSA-N -HMDB0046784 964.845891326 TG(22:0/22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) C63H112O6 ZOOFCAJPCUMJET-HVRWHINPSA-N -HMDB0046809 962.830241262 TG(22:0/22:5(4Z,7Z,10Z,13Z,16Z)/16:1(9Z)) C63H110O6 XFCIPVYPNCSGSK-NHVKAKLUSA-N -HMDB0046833 882.767641004 TG(22:0/18:3(9Z,12Z,15Z)/14:1(9Z)) C57H102O6 QEYIHHBEALJAPR-ROXUKPIWSA-N -HMDB0046835 938.830241262 TG(22:0/18:3(9Z,12Z,15Z)/18:1(11Z)) C61H110O6 NIHHWECWJIEWCW-LPGYKYJVSA-N -HMDB0046836 938.830241262 TG(22:0/18:3(9Z,12Z,15Z)/18:1(9Z)) C61H110O6 WSEOLICCQLXYAB-GFWVYVNBSA-N -HMDB0046837 966.861541391 TG(22:0/18:3(9Z,12Z,15Z)/20:1(11Z)) C63H114O6 JYVPIHBHFXEWIN-ROPUVPJDSA-N -HMDB0046838 962.830241262 TG(22:0/18:3(9Z,12Z,15Z)/20:3(5Z,8Z,11Z)) C63H110O6 WZSWCHGXBYZHMA-ZPIGIMDISA-N -HMDB0046843 964.845891326 TG(22:0/18:3(9Z,12Z,15Z)/20:2n6) C63H112O6 NMHPZWRTPAPYOL-QZHYZABFSA-N -HMDB0046844 962.830241262 TG(22:0/18:3(9Z,12Z,15Z)/20:3n6) C63H110O6 NPZLRDCOUNCXDT-GWNYCUKNSA-N -HMDB0046852 958.798941133 TG(22:0/18:3(9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 HGSNEKPPSIBDLE-QSSNRTBFSA-N -HMDB0046855 926.866626771 TG(22:0/18:3(9Z,12Z,15Z)/o-18:0) C61H114O5 SCMQOOVUTQRBPX-HAPINPQDSA-N -HMDB0046858 880.75199094 TG(22:0/18:4(6Z,9Z,12Z,15Z)/14:1(9Z)) C57H100O6 IHSDKTOLZNRUIJ-PCXGZXBVSA-N -HMDB0046862 964.845891326 TG(22:0/18:4(6Z,9Z,12Z,15Z)/20:1(11Z)) C63H112O6 LGZWDESXZRQBOV-CMYGUDMISA-N -HMDB0046868 962.830241262 TG(22:0/18:4(6Z,9Z,12Z,15Z)/20:2n6) C63H110O6 ZDIIFMFAQBMYEV-CADHATCMSA-N -HMDB0046870 958.798941124 TG(22:0/18:4(6Z,9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 OWJXGNJNFGGSAF-AEABGYOISA-N -HMDB0046876 958.798941133 TG(22:0/18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 QULNTIICGQLJOS-NXJRNUGVSA-N -HMDB0046877 956.783291069 TG(22:0/18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 GWECERDTBORDQQ-JMLGMZHJSA-N -HMDB0046880 924.850976706 TG(22:0/18:4(6Z,9Z,12Z,15Z)/o-18:0) C61H112O5 GUBRCOQXLRVIHB-HWDANKEISA-N -HMDB0046885 964.845891326 TG(22:0/20:4(8Z,11Z,14Z,17Z)/18:1(11Z)) C63H112O6 XDLVHAQCGLBAQF-VMXIGYHQSA-N -HMDB0046886 964.845891326 TG(22:0/20:4(8Z,11Z,14Z,17Z)/18:1(9Z)) C63H112O6 GEGMUTTVHLZEBG-HEKXAYCTSA-N -HMDB0046891 962.830241262 TG(22:0/20:4(8Z,11Z,14Z,17Z)/18:2(9Z,12Z)) C63H110O6 RXEXVUVFJRTYMW-MDTBSHAISA-N -HMDB0046900 958.798941133 TG(22:0/20:4(8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 CQRHWLBMFHTPSF-VJNFPLBVSA-N -HMDB0046905 952.882276835 TG(22:0/20:4(8Z,11Z,14Z,17Z)/o-18:0) C63H116O5 YDNSSVJJLZBKEO-KYKVNZHESA-N -HMDB0046910 962.830241262 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z)) C63H110O6 YPOPSJNSJQLQSC-QZUWEFPESA-N -HMDB0046911 962.830241262 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(9Z)) C63H110O6 IMWXKSCYQVBGON-HCYKTLOTSA-N -HMDB0046917 958.798941133 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(6Z,9Z,12Z)) C63H106O6 FJSARSYJKVJQHG-BNJMEBETSA-N -HMDB0046924 958.798941133 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z)) C63H106O6 ATYQADYSFQGJBV-UZCHJDFASA-N -HMDB0046925 956.783291069 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 FGBZKVMJCSLMNT-YGYUTAOWSA-N -HMDB0046930 950.866626771 TG(22:0/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C63H114O5 LNEGIXKHOVJBCA-HPEDWPGISA-N -HMDB0046934 962.830241262 TG(22:0/22:5(7Z,10Z,13Z,16Z,19Z)/16:1(9Z)) C63H110O6 KFTJSRDBWLUZAR-NUYSAEBSSA-N -HMDB0046983 874.835326642 TG(22:0/o-18:0/14:1(9Z)) C57H110O5 JEERBMFDIWSRBT-IIYWXNMISA-N -HMDB0046984 902.866626771 TG(22:0/o-18:0/16:1(9Z)) C59H114O5 CAPXDNNJSKSNHK-COAUFNLESA-N -HMDB0046987 958.929227028 TG(22:0/o-18:0/20:1(11Z)) C63H122O5 CAOCEUZJFODCFY-SFTFLQKMSA-N -HMDB0046988 954.8979269 TG(22:0/o-18:0/20:3(5Z,8Z,11Z)) C63H118O5 FCFBMPGFGZPIBY-SZPOQHLJSA-N -HMDB0046991 928.882276835 TG(22:0/o-18:0/18:2(9Z,12Z)) C61H116O5 JAOICCCVVONLHB-FMZYJFPSSA-N -HMDB0046992 926.866626771 TG(22:0/o-18:0/18:3(6Z,9Z,12Z)) C61H114O5 DGOPRVUMKXMBBN-GCPRVGKFSA-N -HMDB0046993 956.913576964 TG(22:0/o-18:0/20:2n6) C63H120O5 SXKDYXAVNJJKQE-YAGAPKITSA-N -HMDB0046994 954.8979269 TG(22:0/o-18:0/20:3n6) C63H118O5 NROZTINCWPRCMV-LWEOUFGKSA-N -HMDB0046995 952.882276835 TG(22:0/o-18:0/20:4(5Z,8Z,11Z,14Z)) C63H116O5 WKEWFXQSALSQCQ-MSTNBBFJSA-N -HMDB0046999 926.866626771 TG(22:0/o-18:0/18:3(9Z,12Z,15Z)) C61H114O5 KREDKADJJBSZQK-HAPINPQDSA-N -HMDB0047000 924.850976706 TG(22:0/o-18:0/18:4(6Z,9Z,12Z,15Z)) C61H112O5 KSLLVJBDFZEPTB-ZGKFSGSJSA-N -HMDB0047001 952.882276835 TG(22:0/o-18:0/20:4(8Z,11Z,14Z,17Z)) C63H116O5 ZWRVHEJEANYSRU-UPHNUPBLSA-N -HMDB0047002 950.866626771 TG(22:0/o-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H114O5 HAAANVHPHRLRPS-QVUOHJAASA-N -HMDB0047007 888.814591198 TG(24:0/14:0/16:1(9Z)) C57H108O6 UVYBPHXSHXEHQX-WTNBXCFCSA-N -HMDB0047008 916.845891326 TG(24:0/14:0/18:1(11Z)) C59H112O6 OOHIULWPYUEZRR-BUKBLQRKSA-N -HMDB0047009 916.845891326 TG(24:0/14:0/18:1(9Z)) C59H112O6 JAMTWOKYIOCODD-QKNLQKMTSA-N -HMDB0047011 940.845891326 TG(24:0/14:0/20:3(5Z,8Z,11Z)) C61H112O6 MBEHVCHNDQZWCB-YODUNMEZSA-N -HMDB0047012 972.908491584 TG(24:0/14:0/22:1(13Z)) C63H120O6 PPUWOQZPYWAPRO-NQFAIHCZSA-N -HMDB0047014 914.830241262 TG(24:0/14:0/18:2(9Z,12Z)) C59H110O6 IPMCDSYSCPXHTB-YGKYETHISA-N -HMDB0047016 942.861541391 TG(24:0/14:0/20:2n6) C61H114O6 AGHHOFLCBXWHOS-FURYJAGQSA-N -HMDB0047017 940.845891326 TG(24:0/14:0/20:3n6) C61H112O6 CCYKAYZERNIDEA-FQXMZLCQSA-N -HMDB0047018 938.830241262 TG(24:0/14:0/20:4(5Z,8Z,11Z,14Z)) C61H110O6 KGCOMYRIEUMHBE-QIMKBFHLSA-N -HMDB0047019 970.89284152 TG(24:0/14:0/22:2(13Z,16Z)) C63H118O6 VYZRRPSXSDYNCO-OGZGDILSSA-N -HMDB0047020 966.861541391 TG(24:0/14:0/22:4(7Z,10Z,13Z,16Z)) C63H114O6 SWJAOFQRGQDADV-DDESYYAESA-N -HMDB0047021 964.845891326 TG(24:0/14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O6 ISJUEJIQJNPESE-IQVOXYQMSA-N -HMDB0047024 938.830241262 TG(24:0/14:0/20:4(8Z,11Z,14Z,17Z)) C61H110O6 VGJLRVHUGWORNM-UXNDQROASA-N -HMDB0047026 964.845891326 TG(24:0/14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O6 LTKCBUMGVCUVPG-XQCODHMDSA-N -HMDB0047027 962.830241262 TG(24:0/14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H110O6 AOEMOZQBRAJCGN-DZPQYBBBSA-N -HMDB0047054 888.814591198 TG(24:0/16:0/14:1(9Z)) C57H108O6 QOPDMHCKZZFVHH-IXHOOSMISA-N -HMDB0047055 916.845891326 TG(24:0/16:0/16:1(9Z)) C59H112O6 IZQSAPJJVMUNHL-BUKBLQRKSA-N -HMDB0047058 972.908491584 TG(24:0/16:0/20:1(11Z)) C63H120O6 WOZPSEZFVJBYJL-FLTKJYRDSA-N -HMDB0047059 968.877191455 TG(24:0/16:0/20:3(5Z,8Z,11Z)) C63H116O6 VPGFYQNSTYPTAI-KXCYRNGVSA-N -HMDB0047062 942.861541391 TG(24:0/16:0/18:2(9Z,12Z)) C61H114O6 NSRSRNOQDGUIQQ-AWYLIJQVSA-N -HMDB0047063 940.845891326 TG(24:0/16:0/18:3(6Z,9Z,12Z)) C61H112O6 CSNMMADQHKSQLN-AMLZRHAWSA-N -HMDB0047064 970.89284152 TG(24:0/16:0/20:2n6) C63H118O6 QMUANRQBCWCFMK-PWULZGLXSA-N -HMDB0047065 968.877191455 TG(24:0/16:0/20:3n6) C63H116O6 ABFACKHFNWRLBN-UJOSCSIKSA-N -HMDB0047066 966.861541391 TG(24:0/16:0/20:4(5Z,8Z,11Z,14Z)) C63H114O6 MASGOWIBHUPTSI-SFVLEJGZSA-N -HMDB0047070 940.845891326 TG(24:0/16:0/18:3(9Z,12Z,15Z)) C61H112O6 XMIDMFLTTPZJFG-DTGSQNBHSA-N -HMDB0047071 938.830241262 TG(24:0/16:0/18:4(6Z,9Z,12Z,15Z)) C61H110O6 WAYMRLQEAVIHIN-LQRXYVGKSA-N -HMDB0047072 966.861541391 TG(24:0/16:0/20:4(8Z,11Z,14Z,17Z)) C63H114O6 MLAAGFLYGGJEIR-UJCBBSHKSA-N -HMDB0047073 964.845891326 TG(24:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O6 CSXWGAYDXHHFDH-JDRQHAIFSA-N -HMDB0047078 916.845891326 TG(24:0/18:0/14:1(9Z)) C59H112O6 KWWVXMLEUYDGGY-AAABZKSKSA-N -HMDB0047080 972.908491584 TG(24:0/18:0/18:1(11Z)) C63H120O6 PDFGKXGOWBDITR-SVFUARKBSA-N -HMDB0047081 972.908491584 TG(24:0/18:0/18:1(9Z)) C63H120O6 XZEKHDQNQNUYCG-LTLOUOCESA-N -HMDB0047086 970.89284152 TG(24:0/18:0/18:2(9Z,12Z)) C63H118O6 CLPGGZLOXDCDRW-WFYVVMRGSA-N -HMDB0047087 968.877191455 TG(24:0/18:0/18:3(6Z,9Z,12Z)) C63H116O6 GIPQJGVRFPTGNE-LRSIYDEUSA-N -HMDB0047094 968.877191455 TG(24:0/18:0/18:3(9Z,12Z,15Z)) C63H116O6 URBAOCZNEPINCX-UDMQSNSMSA-N -HMDB0047095 966.861541391 TG(24:0/18:0/18:4(6Z,9Z,12Z,15Z)) C63H114O6 OBQQBOPIPFQDPJ-BVKAFERTSA-N -HMDB0047103 972.908491584 TG(24:0/20:0/16:1(9Z)) C63H120O6 XXHFTCACPARCGZ-RXNSVRMPSA-N -HMDB0047126 972.908491584 TG(24:0/22:0/14:1(9Z)) C63H120O6 FWVLOXKUQLDETR-UMYTVORISA-N -HMDB0047176 914.830241262 TG(24:0/14:1(9Z)/18:1(11Z)) C59H110O6 JCOOWXXKIVGLLZ-MCIXCOEMSA-N -HMDB0047177 914.830241262 TG(24:0/14:1(9Z)/18:1(9Z)) C59H110O6 XHAVMTLJTOZKKY-XXWNTSGZSA-N -HMDB0047178 942.861541391 TG(24:0/14:1(9Z)/20:1(11Z)) C61H114O6 XXGCNFKQIMIEKF-XCYFVEGBSA-N -HMDB0047179 938.830241262 TG(24:0/14:1(9Z)/20:3(5Z,8Z,11Z)) C61H110O6 UFISVPDSQMIDGI-KDBREOEUSA-N -HMDB0047180 970.89284152 TG(24:0/14:1(9Z)/22:1(13Z)) C63H118O6 ABLVQVNHRJIDDA-NYMNXKKASA-N -HMDB0047184 940.845891326 TG(24:0/14:1(9Z)/20:2n6) C61H112O6 QBIXIQXOQCCVJI-QUIYVIRQSA-N -HMDB0047185 938.830241262 TG(24:0/14:1(9Z)/20:3n6) C61H110O6 XDOWEQFXTJXLQK-NQSQMGGWSA-N -HMDB0047187 968.877191455 TG(24:0/14:1(9Z)/22:2(13Z,16Z)) C63H116O6 VQFSLGRGKYUSSR-RBAYELBESA-N -HMDB0047188 964.845891326 TG(24:0/14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H112O6 VHXPQJFOLJPCQU-DXHUEQHBSA-N -HMDB0047189 962.830241262 TG(24:0/14:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 DZKPWYXJQNAJRE-FVVCBLSCSA-N -HMDB0047194 962.830241262 TG(24:0/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 BZZJVZIMQHLYFH-KQYNYONPSA-N -HMDB0047196 902.866626771 TG(24:0/14:1(9Z)/o-18:0) C59H114O5 KWSTWEQIGGYEMX-WYUVFQPTSA-N -HMDB0047199 914.830241252 TG(24:0/16:1(9Z)/16:1(9Z)) C59H110O6 JKLQMZASXAUKDG-ZLUYPCRLSA-N -HMDB0047200 942.861541391 TG(24:0/16:1(9Z)/18:1(11Z)) C61H114O6 WBFSLXIVMFYBJL-GMFCVOFDSA-N -HMDB0047201 942.861541391 TG(24:0/16:1(9Z)/18:1(9Z)) C61H114O6 RKDUCRGKMCKYTN-DBLPNNMMSA-N -HMDB0047202 970.89284152 TG(24:0/16:1(9Z)/20:1(11Z)) C63H118O6 QYDPSHIZJLSVKM-MOBNGOAYSA-N -HMDB0047203 966.861541391 TG(24:0/16:1(9Z)/20:3(5Z,8Z,11Z)) C63H114O6 IRMUTXUYWRLUGE-JTNZRJBRSA-N -HMDB0047206 940.845891326 TG(24:0/16:1(9Z)/18:2(9Z,12Z)) C61H112O6 USMSEKIRTKUMEG-KQSPMYCLSA-N -HMDB0047207 938.830241262 TG(24:0/16:1(9Z)/18:3(6Z,9Z,12Z)) C61H110O6 LBZONYRNSJMDKD-LSZOQQCOSA-N -HMDB0047208 968.877191455 TG(24:0/16:1(9Z)/20:2n6) C63H116O6 RHKGVUCWKLHRQP-XQVSIXSYSA-N -HMDB0047209 966.861541391 TG(24:0/16:1(9Z)/20:3n6) C63H114O6 MPULJGAMFCKYGH-RMDGVKKYSA-N -HMDB0047210 964.845891326 TG(24:0/16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C63H112O6 PTCDSFDXNQAUJF-MKMMENHLSA-N -HMDB0047214 938.830241262 TG(24:0/16:1(9Z)/18:3(9Z,12Z,15Z)) C61H110O6 RCHRBILGWVSBMD-XNMIHLJYSA-N -HMDB0047216 964.845891326 TG(24:0/16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C63H112O6 NWCKRGICIKHKFU-KNSFNSQFSA-N -HMDB0047217 962.830241262 TG(24:0/16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 BSPIFBZEPCECGT-CQYVPLOPSA-N -HMDB0047222 914.830241262 TG(24:0/18:1(11Z)/14:1(9Z)) C59H110O6 ZMOMBZWRGVTTLX-MCIXCOEMSA-N -HMDB0047223 942.861541391 TG(24:0/18:1(11Z)/16:1(9Z)) C61H114O6 PAWWFARWOBDKCZ-GMFCVOFDSA-N -HMDB0047224 970.89284152 TG(24:0/18:1(11Z)/18:1(11Z)) C63H118O6 HSADKDIVCWSNKY-XGLLORPLSA-N -HMDB0047225 970.89284152 TG(24:0/18:1(11Z)/18:1(9Z)) C63H118O6 FXXAUAAYIAECGB-LHHFLNNESA-N -HMDB0047230 968.877191455 TG(24:0/18:1(11Z)/18:2(9Z,12Z)) C63H116O6 RVRTUMVPHQBOPW-ZZLUDCBUSA-N -HMDB0047231 966.861541391 TG(24:0/18:1(11Z)/18:3(6Z,9Z,12Z)) C63H114O6 LSSCZEINTKPCRU-UDBROKPMSA-N -HMDB0047238 966.861541391 TG(24:0/18:1(11Z)/18:3(9Z,12Z,15Z)) C63H114O6 JTMWSXQSMSFDAB-XITMOLFCSA-N -HMDB0047239 964.845891326 TG(24:0/18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C63H112O6 WNTKADGAFKNKPP-YGFWICIISA-N -HMDB0047244 958.929227028 TG(24:0/18:1(11Z)/o-18:0) C63H122O5 AEWUIILVPVQOTF-NYINCGHRSA-N -HMDB0047246 914.830241262 TG(24:0/18:1(9Z)/14:1(9Z)) C59H110O6 SEPILWBSQJWVGW-XXWNTSGZSA-N -HMDB0047247 942.86154138 TG(24:0/18:1(9Z)/16:1(9Z)) C61H114O6 KGUKXPWFPDKTLO-DBLPNNMMSA-N -HMDB0047248 970.89284152 TG(24:0/18:1(9Z)/18:1(11Z)) C63H118O6 GVCWIXNHGLSALQ-KKDRTGKDSA-N -HMDB0047249 970.89284152 TG(24:0/18:1(9Z)/18:1(9Z)) C63H118O6 OZGHAUBMNCOWIH-CCWNELFASA-N -HMDB0047254 968.877191455 TG(24:0/18:1(9Z)/18:2(9Z,12Z)) C63H116O6 LZWYQOUXYAEBEU-QZWBWMDUSA-N -HMDB0047255 966.861541391 TG(24:0/18:1(9Z)/18:3(6Z,9Z,12Z)) C63H114O6 BLEZXNLVEWZCRH-SDNRSMOOSA-N -HMDB0047262 966.861541391 TG(24:0/18:1(9Z)/18:3(9Z,12Z,15Z)) C63H114O6 AGZNGMZBQPKGJK-NKNKUKIVSA-N -HMDB0047263 964.845891326 TG(24:0/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C63H112O6 OWLALMGEVBJBJV-GLXVKYISSA-N -HMDB0047268 958.929227028 TG(24:0/18:1(9Z)/o-18:0) C63H122O5 OIXSAFSNRKDPLC-KPUVNLRISA-N -HMDB0047270 942.861541391 TG(24:0/20:1(11Z)/14:1(9Z)) C61H114O6 NXBSSTRUFABJPB-XCYFVEGBSA-N -HMDB0047271 970.89284152 TG(24:0/20:1(11Z)/16:1(9Z)) C63H118O6 WLQOSKFMJPLCIL-MOBNGOAYSA-N -HMDB0047294 938.830241262 TG(24:0/20:3(5Z,8Z,11Z)/14:1(9Z)) C61H110O6 WZTGTJAUXOIVNF-SKVYXICMSA-N -HMDB0047295 966.861541391 TG(24:0/20:3(5Z,8Z,11Z)/16:1(9Z)) C63H114O6 WICCDJPCCTZLBO-SKTYPZPBSA-N -HMDB0047318 970.89284152 TG(24:0/22:1(13Z)/14:1(9Z)) C63H118O6 LQUXSTRECRGYRZ-NYMNXKKASA-N -HMDB0047367 940.845891326 TG(24:0/18:2(9Z,12Z)/16:1(9Z)) C61H112O6 UJXQJJSLQLGCCL-KQSPMYCLSA-N -HMDB0047368 968.877191455 TG(24:0/18:2(9Z,12Z)/18:1(11Z)) C63H116O6 IYSLCAKQDCKAPA-SLWPVJLKSA-N -HMDB0047369 968.877191455 TG(24:0/18:2(9Z,12Z)/18:1(9Z)) C63H116O6 MDAOMPFQZJLFBG-HOJSXSTESA-N -HMDB0047374 966.861541391 TG(24:0/18:2(9Z,12Z)/18:2(9Z,12Z)) C63H114O6 MENKUUOOQRGDSS-IUNRMFRSSA-N -HMDB0047375 964.845891326 TG(24:0/18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) C63H112O6 SYCPSWRZYSSYMM-KSAGRNAESA-N -HMDB0047382 964.845891326 TG(24:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C63H112O6 NCTGMGBJXWCUSU-SOTXLCDASA-N -HMDB0047383 962.830241262 TG(24:0/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 AQUHVGHTBSILQP-FKZIQONFSA-N -HMDB0047388 956.913576964 TG(24:0/18:2(9Z,12Z)/o-18:0) C63H120O5 RIVUGQBNZQXMMO-RVEZQVEJSA-N -HMDB0047391 938.830241262 TG(24:0/18:3(6Z,9Z,12Z)/16:1(9Z)) C61H110O6 MLKVMZHDVPFECT-VCPUAHPWSA-N -HMDB0047392 966.861541391 TG(24:0/18:3(6Z,9Z,12Z)/18:1(11Z)) C63H114O6 KZYYSJQGDAJSBI-IPBIKHCZSA-N -HMDB0047393 966.861541391 TG(24:0/18:3(6Z,9Z,12Z)/18:1(9Z)) C63H114O6 JZYOAWXKTIAAOD-FJRSCSTLSA-N -HMDB0047398 964.845891326 TG(24:0/18:3(6Z,9Z,12Z)/18:2(9Z,12Z)) C63H112O6 JFSBSLVFROLCLU-DSVQNSBCSA-N -HMDB0047399 962.830241262 TG(24:0/18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)) C63H110O6 MOFDKHZXLRZVOO-CGGKSPRESA-N -HMDB0047406 962.830241262 TG(24:0/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)) C63H110O6 GSINXERSHYXLOO-JKDVKRPSSA-N -HMDB0047412 954.8979269 TG(24:0/18:3(6Z,9Z,12Z)/o-18:0) C63H118O5 BTMVDFIHILPGTB-SNWIDWGDSA-N -HMDB0047414 940.845891326 TG(24:0/20:2n6/14:1(9Z)) C61H112O6 JTAZFPZUAINKAO-QUIYVIRQSA-N -HMDB0047415 968.877191455 TG(24:0/20:2n6/16:1(9Z)) C63H116O6 XKLBAGAZJABNLI-XQVSIXSYSA-N -HMDB0047438 938.830241262 TG(24:0/20:3n6/14:1(9Z)) C61H110O6 XGRHXRCXVVXNRR-KDGHHESYSA-N -HMDB0047439 966.861541391 TG(24:0/20:3n6/16:1(9Z)) C63H114O6 JPJMXAFPVUPHGK-UPCHYJRJSA-N -HMDB0047463 964.845891326 TG(24:0/20:4(5Z,8Z,11Z,14Z)/16:1(9Z)) C63H112O6 LWZVEKQNTUNOHB-MTWIKBTCSA-N -HMDB0047486 968.877191455 TG(24:0/22:2(13Z,16Z)/14:1(9Z)) C63H116O6 UBOALFOWVHLTCP-RBAYELBESA-N -HMDB0047510 964.845891326 TG(24:0/22:4(7Z,10Z,13Z,16Z)/14:1(9Z)) C63H112O6 RBAXJCVLSUEXJH-WCBQSPGLSA-N -HMDB0047534 962.830241262 TG(24:0/22:5(4Z,7Z,10Z,13Z,16Z)/14:1(9Z)) C63H110O6 DXLAYYUDUQMJEA-WHNXSCMQSA-N -HMDB0047559 938.830241262 TG(24:0/18:3(9Z,12Z,15Z)/16:1(9Z)) C61H110O6 JCQPLTYLLRMKIQ-XNMIHLJYSA-N -HMDB0047560 966.861541391 TG(24:0/18:3(9Z,12Z,15Z)/18:1(11Z)) C63H114O6 MSQOAJJKBRJHKC-WOXGTIBRSA-N -HMDB0047561 966.861541391 TG(24:0/18:3(9Z,12Z,15Z)/18:1(9Z)) C63H114O6 AHYOFQHJCROZHS-WHTAAGGISA-N -HMDB0047566 964.845891326 TG(24:0/18:3(9Z,12Z,15Z)/18:2(9Z,12Z)) C63H112O6 FJCZNIRVTYQYOI-KTJVZGKESA-N -HMDB0047567 962.830241262 TG(24:0/18:3(9Z,12Z,15Z)/18:3(6Z,9Z,12Z)) C63H110O6 FKDVIQPHQIWBSH-AEOIDKGLSA-N -HMDB0047574 962.830241262 TG(24:0/18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)) C63H110O6 NVDYXXAEDSIYNY-FBCHIRCKSA-N -HMDB0047580 954.8979269 TG(24:0/18:3(9Z,12Z,15Z)/o-18:0) C63H118O5 LHGYPMLTLDHXRM-KHKGUJNRSA-N -HMDB0047584 964.845891326 TG(24:0/18:4(6Z,9Z,12Z,15Z)/18:1(11Z)) C63H112O6 YHXPJGXXXHDEDU-LPBBNXRDSA-N -HMDB0047585 964.845891326 TG(24:0/18:4(6Z,9Z,12Z,15Z)/18:1(9Z)) C63H112O6 QYSAZPWQWDQBMK-HJWCOGPNSA-N -HMDB0047590 962.830241262 TG(24:0/18:4(6Z,9Z,12Z,15Z)/18:2(9Z,12Z)) C63H110O6 DZRDCZBPJFZULK-GFQNSZRUSA-N -HMDB0047599 958.798941133 TG(24:0/18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 JNWUZJVVSINCRU-MPCBJDOISA-N -HMDB0047604 952.882276835 TG(24:0/18:4(6Z,9Z,12Z,15Z)/o-18:0) C63H116O5 YRIBGJSBLCTVJS-UYUBXDOXSA-N -HMDB0047607 964.845891326 TG(24:0/20:4(8Z,11Z,14Z,17Z)/16:1(9Z)) C63H112O6 BDAAUVXVYYGPNU-DJNMVNNCSA-N -HMDB0047631 962.830241262 TG(24:0/20:5(5Z,8Z,11Z,14Z,17Z)/16:1(9Z)) C63H110O6 YERFYJOKWWABQO-NNZNBNOOSA-N -HMDB0047654 962.830241262 TG(24:0/22:5(7Z,10Z,13Z,16Z,19Z)/14:1(9Z)) C63H110O6 HTYGMBXFTNEZHO-DYONDRKSSA-N -HMDB0047702 902.866626771 TG(24:0/o-18:0/14:1(9Z)) C59H114O5 FUAWAXRBBSTPLW-WYUVFQPTSA-N -HMDB0047704 958.929227028 TG(24:0/o-18:0/18:1(11Z)) C63H122O5 KGEVQMGAUYEWTD-NYINCGHRSA-N -HMDB0047705 958.929227028 TG(24:0/o-18:0/18:1(9Z)) C63H122O5 HQQQOQMFXJYUMG-KPUVNLRISA-N -HMDB0047710 956.913576964 TG(24:0/o-18:0/18:2(9Z,12Z)) C63H120O5 OTARVUCVZUWLOP-RVEZQVEJSA-N -HMDB0047711 954.8979269 TG(24:0/o-18:0/18:3(6Z,9Z,12Z)) C63H118O5 MNBYMCVZZONTET-ZIAGUZGGSA-N -HMDB0047718 954.8979269 TG(24:0/o-18:0/18:3(9Z,12Z,15Z)) C63H118O5 JNIVZFHKRHKLRF-KHKGUJNRSA-N -HMDB0047719 952.882276835 TG(24:0/o-18:0/18:4(6Z,9Z,12Z,15Z)) C63H116O5 FAAHFCOXNIGEMO-GFAJMFIRSA-N -HMDB0047760 842.736340876 TG(14:1(9Z)/15:0/22:2(13Z,16Z)) C54H98O6 QGSFHGSYPKDCBO-OCCKZLQQSA-N -HMDB0047783 856.75199094 TG(14:1(9Z)/16:0/22:2(13Z,16Z)) C55H100O6 QZRITKSXWHDXFB-AQMPJRPXSA-N -HMDB0047784 852.720690811 TG(14:1(9Z)/16:0/22:4(7Z,10Z,13Z,16Z)) C55H96O6 DJBSAGJERMKCDN-PNPLQMKDSA-N -HMDB0047800 914.830241262 TG(14:1(9Z)/18:0/24:1(15Z)) C59H110O6 CDJBHUGXUCDURI-AZKDRWSUSA-N -HMDB0047803 856.75199094 TG(14:1(9Z)/18:0/20:2n6) C55H100O6 FSTDLLFKLQLNCY-LPLBOQDCSA-N -HMDB0047805 852.720690811 TG(14:1(9Z)/18:0/20:4(5Z,8Z,11Z,14Z)) C55H96O6 LMDMXKYAEKPMRJ-XKMHHYLWSA-N -HMDB0047806 884.783291069 TG(14:1(9Z)/18:0/22:2(13Z,16Z)) C57H104O6 TYUOYBHEQWBQON-YXBKKIBYSA-N -HMDB0047807 880.75199094 TG(14:1(9Z)/18:0/22:4(7Z,10Z,13Z,16Z)) C57H100O6 FAEIJJBFHNTKST-FCJLYCLESA-N -HMDB0047811 852.720690811 TG(14:1(9Z)/18:0/20:4(8Z,11Z,14Z,17Z)) C55H96O6 DAAWWDSQUNUMHY-QRSUAQOQSA-N -HMDB0047821 882.767641004 TG(14:1(9Z)/20:0/20:3(5Z,8Z,11Z)) C57H102O6 DIKFHEKYQJZAEV-AILMYUQKSA-N -HMDB0047822 914.830241262 TG(14:1(9Z)/20:0/22:1(13Z)) C59H110O6 QMOZRBHWRVHQOJ-AZKDRWSUSA-N -HMDB0047823 942.861541391 TG(14:1(9Z)/20:0/24:1(15Z)) C61H114O6 XJZRZLMCPQTTIU-GWPMROEHSA-N -HMDB0047824 856.75199094 TG(14:1(9Z)/20:0/18:2(9Z,12Z)) C55H100O6 RFMPQNSSBPXIIY-HLUBQEQQSA-N -HMDB0047826 884.783291069 TG(14:1(9Z)/20:0/20:2n6) C57H104O6 NUYRINJQOPQTKC-YXBKKIBYSA-N -HMDB0047827 882.767641004 TG(14:1(9Z)/20:0/20:3n6) C57H102O6 AUEYCFPJLUPBLD-VBAODHEZSA-N -HMDB0047828 880.75199094 TG(14:1(9Z)/20:0/20:4(5Z,8Z,11Z,14Z)) C57H100O6 FCJIOGHLJHBKRR-KTSHDULSSA-N -HMDB0047833 852.720690811 TG(14:1(9Z)/20:0/18:4(6Z,9Z,12Z,15Z)) C55H96O6 QATNEARFLCYVEE-JVUXECHJSA-N -HMDB0047834 880.75199094 TG(14:1(9Z)/20:0/20:4(8Z,11Z,14Z,17Z)) C57H100O6 LKBVKNFLTKNLFF-RWCMAYOLSA-N -HMDB0047843 914.830241262 TG(14:1(9Z)/22:0/20:1(11Z)) C59H110O6 VOLUUICWFQPQGG-ZUZBGFAESA-N -HMDB0047845 942.861541391 TG(14:1(9Z)/22:0/22:1(13Z)) C61H114O6 DPOKSOYZNAGELJ-GWPMROEHSA-N -HMDB0047846 970.89284152 TG(14:1(9Z)/22:0/24:1(15Z)) C63H118O6 MYYDVRKVUNECKQ-BHTARXBPSA-N -HMDB0047847 884.783291069 TG(14:1(9Z)/22:0/18:2(9Z,12Z)) C57H104O6 AXFNIIJYCHZARY-ZTIYBWLLSA-N -HMDB0047848 882.767641004 TG(14:1(9Z)/22:0/18:3(6Z,9Z,12Z)) C57H102O6 VJRAKLSHWUZUGJ-KQNBKZFHSA-N -HMDB0047852 940.845891326 TG(14:1(9Z)/22:0/22:2(13Z,16Z)) C61H112O6 XORGQMNRBOZGBM-WVHAEAGOSA-N -HMDB0047855 882.767641004 TG(14:1(9Z)/22:0/18:3(9Z,12Z,15Z)) C57H102O6 LSLCAMBCQCOKNH-QJGMYCCBSA-N -HMDB0047856 880.75199094 TG(14:1(9Z)/22:0/18:4(6Z,9Z,12Z,15Z)) C57H100O6 HIHQJJVDWLEWFD-VMHSLYIXSA-N -HMDB0047861 874.835326642 TG(14:1(9Z)/22:0/o-18:0) C57H110O5 YIPJUHYAYCZWRJ-IIYWXNMISA-N -HMDB0047864 914.830241262 TG(14:1(9Z)/24:0/18:1(11Z)) C59H110O6 ZQMZDXCKJADKAC-CQKAMUCVSA-N -HMDB0047865 914.830241262 TG(14:1(9Z)/24:0/18:1(9Z)) C59H110O6 UDBFLEBTRNBEBZ-LRLWVPGOSA-N -HMDB0047866 942.861541391 TG(14:1(9Z)/24:0/20:1(11Z)) C61H114O6 PVJPHQHSWUWAQJ-YTGWZONKSA-N -HMDB0047867 938.830241262 TG(14:1(9Z)/24:0/20:3(5Z,8Z,11Z)) C61H110O6 RQHDZVBUHNJLAI-CBPFIWIXSA-N -HMDB0047868 970.89284152 TG(14:1(9Z)/24:0/22:1(13Z)) C63H118O6 PASXLGNHMHBIKZ-PQHWJMJOSA-N -HMDB0047872 940.845891326 TG(14:1(9Z)/24:0/20:2n6) C61H112O6 ZJPRUJQVOSHYAD-FOKIDFPCSA-N -HMDB0047873 938.830241262 TG(14:1(9Z)/24:0/20:3n6) C61H110O6 VARKWBYIQXSEHP-DQRLJEGTSA-N -HMDB0047875 968.877191455 TG(14:1(9Z)/24:0/22:2(13Z,16Z)) C63H116O6 JVIIPAKFIVOQGP-MGVDFNTRSA-N -HMDB0047876 964.845891326 TG(14:1(9Z)/24:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 PPKIZYUIIFPNOZ-CJLXBWGESA-N -HMDB0047877 962.830241262 TG(14:1(9Z)/24:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 LOQLDSZRHWTGNQ-SLKRHJEASA-N -HMDB0047882 962.830241262 TG(14:1(9Z)/24:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 RDIKTUSAPKAQOH-HSLIIHMISA-N -HMDB0047884 902.866626771 TG(14:1(9Z)/24:0/o-18:0) C59H114O5 IFAFZYRLCMKOIJ-WYUVFQPTSA-N -HMDB0047892 856.75199094 TG(14:1(9Z)/14:1(9Z)/24:1(15Z)) C55H100O6 DTWPBANPCJFNIA-QNOCGCPESA-N -HMDB0047914 856.75199094 TG(14:1(9Z)/16:1(9Z)/22:1(13Z)) C55H100O6 ARRWAWFZJHRGLN-RUTWIJPDSA-N -HMDB0047915 884.783291069 TG(14:1(9Z)/16:1(9Z)/24:1(15Z)) C57H104O6 BIBCTHOYLBOAJR-FQVFIEMGSA-N -HMDB0047935 856.75199094 TG(14:1(9Z)/18:1(11Z)/20:1(11Z)) C55H100O6 MGUXHCYCFLVGES-WWAUBUJQSA-N -HMDB0047936 852.720690811 TG(14:1(9Z)/18:1(11Z)/20:3(5Z,8Z,11Z)) C55H96O6 QGLNBMRMNJAFOO-MBMJTBHTSA-N -HMDB0047937 884.783291069 TG(14:1(9Z)/18:1(11Z)/22:1(13Z)) C57H104O6 WUTNRLSFTGCBMN-QSCSLWOISA-N -HMDB0047942 852.720690811 TG(14:1(9Z)/18:1(11Z)/20:3n6) C55H96O6 NKWRAFYNNIEZPH-LLQMOOPJSA-N -HMDB0047944 882.767641004 TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z)) C57H102O6 XUSMNDFFJSIIQR-PVVBFDGQSA-N -HMDB0047958 856.75199094 TG(14:1(9Z)/18:1(9Z)/20:1(11Z)) C55H100O6 RYWWBXHDEGSCOG-GAAGLFOXSA-N -HMDB0047959 852.720690811 TG(14:1(9Z)/18:1(9Z)/20:3(5Z,8Z,11Z)) C55H96O6 UAXBSAJQKYIKRG-KFYGEJDJSA-N -HMDB0047960 884.783291069 TG(14:1(9Z)/18:1(9Z)/22:1(13Z)) C57H104O6 GBTKABUIAQMAPV-JEQUJCETSA-N -HMDB0047965 852.720690811 TG(14:1(9Z)/18:1(9Z)/20:3n6) C55H96O6 CGPMDMDZQFZLHH-JOBYQNAZSA-N -HMDB0047967 882.767641004 TG(14:1(9Z)/18:1(9Z)/22:2(13Z,16Z)) C57H102O6 CNRGDEVLIJIREE-CPRBWVNASA-N -HMDB0047979 856.75199094 TG(14:1(9Z)/20:1(11Z)/18:1(11Z)) C55H100O6 HWXYJCBLRIWFEE-WWAUBUJQSA-N -HMDB0047980 856.75199094 TG(14:1(9Z)/20:1(11Z)/18:1(9Z)) C55H100O6 YMPDPPQASWDPRK-GAAGLFOXSA-N -HMDB0047981 884.783291069 TG(14:1(9Z)/20:1(11Z)/20:1(11Z)) C57H104O6 OPZBOXKFTDVAOR-JXQORKFYSA-N -HMDB0047982 880.75199094 TG(14:1(9Z)/20:1(11Z)/20:3(5Z,8Z,11Z)) C57H100O6 DHQUEWMLMFUPTL-YSSJDGIJSA-N -HMDB0047984 940.845891326 TG(14:1(9Z)/20:1(11Z)/24:1(15Z)) C61H112O6 UVNIPBFYITWPNW-KCPLLMEXSA-N -HMDB0047986 852.720690811 TG(14:1(9Z)/20:1(11Z)/18:3(6Z,9Z,12Z)) C55H96O6 WYUKTVBUNYZEPG-UKGLDPHJSA-N -HMDB0047987 882.767641004 TG(14:1(9Z)/20:1(11Z)/20:2n6) C57H102O6 BGODCVGWEBYLGN-UTXPKRQLSA-N -HMDB0047988 880.75199094 TG(14:1(9Z)/20:1(11Z)/20:3n6) C57H100O6 BCMHHAAVHIRHKO-XLWYRELXSA-N -HMDB0047993 852.720690811 TG(14:1(9Z)/20:1(11Z)/18:3(9Z,12Z,15Z)) C55H96O6 TYVUFKFTHSFXIT-XDBIBJELSA-N -HMDB0048002 852.720690811 TG(14:1(9Z)/20:3(5Z,8Z,11Z)/18:1(11Z)) C55H96O6 QBKIULACTZPXJR-OTWOXXSYSA-N -HMDB0048003 852.720690811 TG(14:1(9Z)/20:3(5Z,8Z,11Z)/18:1(9Z)) C55H96O6 DELOENOPQWJVLP-KLTXJGCRSA-N -HMDB0048004 880.75199094 TG(14:1(9Z)/20:3(5Z,8Z,11Z)/20:1(11Z)) C57H100O6 JMNWHZCLZAOONT-JHXKXPALSA-N -HMDB0048015 900.720690811 TG(14:1(9Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 HASCFYSLDYFKJC-LAOBDLPTSA-N -HMDB0048020 900.720690811 TG(14:1(9Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 XNDJLJYFFTWUTN-HBEPBMFUSA-N -HMDB0048024 856.75199094 TG(14:1(9Z)/22:1(13Z)/16:1(9Z)) C55H100O6 WUUWBWLVYRBSQT-RUTWIJPDSA-N -HMDB0048025 884.783291069 TG(14:1(9Z)/22:1(13Z)/18:1(11Z)) C57H104O6 FODKVBNCUCXQDG-QSCSLWOISA-N -HMDB0048026 884.783291069 TG(14:1(9Z)/22:1(13Z)/18:1(9Z)) C57H104O6 ZITWCTCGAATZHT-JEQUJCETSA-N -HMDB0048029 940.845891326 TG(14:1(9Z)/22:1(13Z)/22:1(13Z)) C61H112O6 FDMDMGLROVNITG-KCPLLMEXSA-N -HMDB0048030 968.877191455 TG(14:1(9Z)/22:1(13Z)/24:1(15Z)) C63H116O6 USJFTUJSTHNKJJ-BKDMQJNTSA-N -HMDB0048031 882.767641004 TG(14:1(9Z)/22:1(13Z)/18:2(9Z,12Z)) C57H102O6 WMXYDRBAGJDSCG-UQXSDYQWSA-N -HMDB0048032 880.75199094 TG(14:1(9Z)/22:1(13Z)/18:3(6Z,9Z,12Z)) C57H100O6 FFFBJYLAWNZQBW-ANICQBBUSA-N -HMDB0048036 938.830241262 TG(14:1(9Z)/22:1(13Z)/22:2(13Z,16Z)) C61H110O6 RIPMVOUZKWTQDO-NZHHDDOLSA-N -HMDB0048039 880.75199094 TG(14:1(9Z)/22:1(13Z)/18:3(9Z,12Z,15Z)) C57H100O6 CSWKLJWLTNNDPE-OCOJWXJXSA-N -HMDB0048046 856.751990932 TG(14:1(9Z)/24:1(15Z)/14:1(9Z)) C55H100O6 GEDOOJBTRRNYEP-HAOPMPSJSA-N -HMDB0048047 884.783291069 TG(14:1(9Z)/24:1(15Z)/16:1(9Z)) C57H104O6 ZXYLDUDAXJJFMZ-FQVFIEMGSA-N -HMDB0048050 940.845891326 TG(14:1(9Z)/24:1(15Z)/20:1(11Z)) C61H112O6 KZTAYHHQGGVNPE-KCPLLMEXSA-N -HMDB0048052 968.877191455 TG(14:1(9Z)/24:1(15Z)/22:1(13Z)) C63H116O6 RZHKUNBPKZZKQV-BKDMQJNTSA-N -HMDB0048056 938.830241262 TG(14:1(9Z)/24:1(15Z)/20:2n6) C61H110O6 NXTVIXLFALVIBZ-IZGZYJOESA-N -HMDB0048059 966.861541391 TG(14:1(9Z)/24:1(15Z)/22:2(13Z,16Z)) C63H114O6 NZGZMFGERFXOQI-QDUPTCFUSA-N -HMDB0048060 962.830241262 TG(14:1(9Z)/24:1(15Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 ZULICJDFTKHDTK-VCKFMQQUSA-N -HMDB0048067 958.798941133 TG(14:1(9Z)/24:1(15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 IBUWOVXDFGLFPQ-CCAJHUHLSA-N -HMDB0048068 900.850976706 TG(14:1(9Z)/24:1(15Z)/o-18:0) C59H112O5 MNMVLKRCYQXAJF-LRLRNOKKSA-N -HMDB0048075 882.767641004 TG(14:1(9Z)/18:2(9Z,12Z)/22:1(13Z)) C57H102O6 RQEKPMWGSCALDR-UQXSDYQWSA-N -HMDB0048079 852.720690811 TG(14:1(9Z)/18:2(9Z,12Z)/20:2n6) C55H96O6 FHMSYFQZXWGGAR-OKEXGHLUSA-N -HMDB0048082 880.75199094 TG(14:1(9Z)/18:2(9Z,12Z)/22:2(13Z,16Z)) C57H100O6 POHNOIJAASRKQU-DBWLQLOESA-N -HMDB0048096 852.720690811 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/20:1(11Z)) C55H96O6 PHSOZYZQNQNQAK-CVHNYEHWSA-N -HMDB0048098 880.75199094 TG(14:1(9Z)/18:3(6Z,9Z,12Z)/22:1(13Z)) C57H100O6 CTDMUXKSVFRWMX-MPOJCHKNSA-N -HMDB0048119 882.767641004 TG(14:1(9Z)/20:2n6/20:1(11Z)) C57H102O6 YIKPYYUODQLYRB-ZTDVLWJBSA-N -HMDB0048122 938.830241262 TG(14:1(9Z)/20:2n6/24:1(15Z)) C61H110O6 QAVLFIAVSWNWOP-IZGZYJOESA-N -HMDB0048123 852.720690811 TG(14:1(9Z)/20:2n6/18:2(9Z,12Z)) 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TG(14:1(9Z)/20:4(5Z,8Z,11Z,14Z)/o-18:0) C55H98O5 IXEARPXRHLLVNK-YOOXGPEZSA-N -HMDB0048186 882.767641004 TG(14:1(9Z)/22:2(13Z,16Z)/18:1(11Z)) C57H102O6 QCKZCPLWSOKIIF-PVVBFDGQSA-N -HMDB0048187 882.767641004 TG(14:1(9Z)/22:2(13Z,16Z)/18:1(9Z)) C57H102O6 JBLLHDWARKBXDR-CPRBWVNASA-N -HMDB0048190 938.830241262 TG(14:1(9Z)/22:2(13Z,16Z)/22:1(13Z)) C61H110O6 XJPANQUZKYHYSG-IZGZYJOESA-N -HMDB0048191 966.861541391 TG(14:1(9Z)/22:2(13Z,16Z)/24:1(15Z)) C63H114O6 XVGWHPBTFCPJEQ-QDUPTCFUSA-N -HMDB0048192 880.75199094 TG(14:1(9Z)/22:2(13Z,16Z)/18:2(9Z,12Z)) C57H100O6 FRHNALHHTGKIGG-DBWLQLOESA-N -HMDB0048206 870.804026513 TG(14:1(9Z)/22:2(13Z,16Z)/o-18:0) C57H106O5 QAKLYWYMXOZHCJ-OFNFBCEFSA-N -HMDB0048214 962.830241262 TG(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)/24:1(15Z)) C63H110O6 FZZMMDPBSSQSEG-XQVJMJGESA-N -HMDB0048219 900.720690811 TG(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 ATDIOVCHAKPQSA-KDIYWSEJSA-N -HMDB0048225 900.720690811 TG(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) 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TG(14:1(9Z)/20:4(8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C59H96O6 GWAVHAUKODFLGT-UCPRMEQRSA-N -HMDB0048321 838.741426256 TG(14:1(9Z)/20:4(8Z,11Z,14Z,17Z)/o-18:0) C55H98O5 PRBBZGQORJEBML-HTNVVQHESA-N -HMDB0048350 900.720690811 TG(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C59H96O6 URNTVXPNKOGORD-LWPHQFSZSA-N -HMDB0048356 900.720690811 TG(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:3n6) C59H96O6 JQLUSEPGRGEFIO-MOHFFBQJSA-N -HMDB0048360 924.720690811 TG(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C61H96O6 YAQCQKUWLQDYCJ-UOVCUKENSA-N -HMDB0048365 924.720690811 TG(14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 SGGVBZZJDDBPJU-XEBVSVNESA-N -HMDB0048375 958.798941133 TG(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/24:1(15Z)) C63H106O6 UYTLNZBFEBCSPM-XXJASNBMSA-N -HMDB0048378 900.720690811 TG(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2n6) C59H96O6 BTSPSCRQQWFSPQ-OFQAGCFRSA-N -HMDB0048382 924.720690811 TG(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C61H96O6 LVLJROQTWFUTBY-OUOQRASRSA-N -HMDB0048398 900.850976706 TG(14:1(9Z)/o-18:0/24:1(15Z)) C59H112O5 XNHWYHFYYUALLY-UHLYPTQTSA-N -HMDB0048401 842.772726384 TG(14:1(9Z)/o-18:0/20:2n6) C55H102O5 OYGBKABOKBWAOA-PWMLTBMOSA-N -HMDB0048403 838.741426256 TG(14:1(9Z)/o-18:0/20:4(5Z,8Z,11Z,14Z)) C55H98O5 UBYXSIWFCYZTHX-MCHRJMMYSA-N -HMDB0048404 870.804026513 TG(14:1(9Z)/o-18:0/22:2(13Z,16Z)) C57H106O5 NWUHDVPEYQTVME-RRVGRDLBSA-N -HMDB0048405 866.772726384 TG(14:1(9Z)/o-18:0/22:4(7Z,10Z,13Z,16Z)) C57H102O5 LWCKIESQXRPOHD-HEYFZOEJSA-N -HMDB0048409 838.741426256 TG(14:1(9Z)/o-18:0/20:4(8Z,11Z,14Z,17Z)) C55H98O5 YKKMFXGDUMHZFK-TVHVYOQCSA-N -HMDB0048425 856.75199094 TG(16:1(9Z)/14:0/22:2(13Z,16Z)) C55H100O6 PPLCXIXCJSJOOR-QPRILOHKSA-N -HMDB0048426 852.720690811 TG(16:1(9Z)/14:0/22:4(7Z,10Z,13Z,16Z)) C55H96O6 MDXVSMKNQLMYQZ-MUYBOSFNSA-N -HMDB0048444 842.736340876 TG(16:1(9Z)/15:0/20:2n6) C54H98O6 WVBFGMOFOIEXMP-QJWNQIOASA-N -HMDB0048457 802.70504074 TG(16:1(9Z)/16:0/16:1(9Z)) C51H94O6 XYKBFKVMVVJQIJ-IKJQKJQYSA-N -HMDB0048463 914.830241262 TG(16:1(9Z)/16:0/24:1(15Z)) C59H110O6 PPRQNLZEKMZHBT-FKSTTXIDSA-N -HMDB0048466 856.75199094 TG(16:1(9Z)/16:0/20:2n6) C55H100O6 NTANLNVWSGZVNG-MTFYTBQQSA-N -HMDB0048468 852.720690811 TG(16:1(9Z)/16:0/20:4(5Z,8Z,11Z,14Z)) C55H96O6 MPJVJPDVMFMULD-XIXMKOIVSA-N -HMDB0048469 884.783291069 TG(16:1(9Z)/16:0/22:2(13Z,16Z)) C57H104O6 LGEZSPSFVTXJTF-MLJGIAGDSA-N -HMDB0048470 880.75199094 TG(16:1(9Z)/16:0/22:4(7Z,10Z,13Z,16Z)) C57H100O6 LRPHUHNPXZVJHC-ALZNIZKHSA-N -HMDB0048474 852.720690811 TG(16:1(9Z)/16:0/20:4(8Z,11Z,14Z,17Z)) C55H96O6 WRMBXJIECLAGIV-LGPIHYRSSA-N -HMDB0048483 882.767641004 TG(16:1(9Z)/18:0/20:3(5Z,8Z,11Z)) C57H102O6 IJAGVFPXKMAQRV-PGYKOVLESA-N -HMDB0048484 914.830241262 TG(16:1(9Z)/18:0/22:1(13Z)) C59H110O6 RKMYDQZHNDAFDU-VFBDGFDBSA-N -HMDB0048485 942.861541391 TG(16:1(9Z)/18:0/24:1(15Z)) C61H114O6 FLMVCURKTYUWQF-RHKJSXQCSA-N -HMDB0048488 884.783291069 TG(16:1(9Z)/18:0/20:2n6) C57H104O6 WACLWOAQCVZQHO-XXQKTQNQSA-N 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TG(16:1(9Z)/20:0/o-18:0) C57H110O5 PKWPXOXGYXWVKK-AYMZKUIOSA-N -HMDB0048524 914.830241262 TG(16:1(9Z)/22:0/18:1(11Z)) C59H110O6 SAZDDXQYEIJVSC-WXUBJASCSA-N -HMDB0048525 914.830241262 TG(16:1(9Z)/22:0/18:1(9Z)) C59H110O6 ZPJFCNOYMFWVHX-GXGVICTKSA-N -HMDB0048526 942.861541391 TG(16:1(9Z)/22:0/20:1(11Z)) C61H114O6 WJMXDOSYJOVEGP-DMQVVFPPSA-N -HMDB0048527 938.830241262 TG(16:1(9Z)/22:0/20:3(5Z,8Z,11Z)) C61H110O6 WAJPTWUYDRSLNY-HHGQFJELSA-N -HMDB0048528 970.89284152 TG(16:1(9Z)/22:0/22:1(13Z)) C63H118O6 CISSBQIGKKYEPB-ZCSYOJTKSA-N -HMDB0048532 940.845891326 TG(16:1(9Z)/22:0/20:2n6) C61H112O6 UOUKSIKNMFLSOA-XCRVDNAJSA-N -HMDB0048533 938.830241262 TG(16:1(9Z)/22:0/20:3n6) C61H110O6 JKXYRUMPRSILQY-PDGVUXAPSA-N -HMDB0048535 968.877191455 TG(16:1(9Z)/22:0/22:2(13Z,16Z)) C63H116O6 JKTCMEHHQOHFEA-HWEVJLRKSA-N -HMDB0048536 964.845891326 TG(16:1(9Z)/22:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 HSNAKNZDCUCCNE-WYEJDGEESA-N -HMDB0048537 962.830241262 TG(16:1(9Z)/22:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 WBUNYBCPBJAPRX-IJYZMPSJSA-N -HMDB0048542 962.830241262 TG(16:1(9Z)/22:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 FNBKULXEHXAYLR-DZRVHWHTSA-N -HMDB0048544 902.866626771 TG(16:1(9Z)/22:0/o-18:0) C59H114O5 ZTOPVHNXZUMKFI-COAUFNLESA-N -HMDB0048545 914.830241252 TG(16:1(9Z)/24:0/16:1(9Z)) C59H110O6 AKRDICGFDXTDDB-XFUYORNGSA-N -HMDB0048546 942.861541391 TG(16:1(9Z)/24:0/18:1(11Z)) C61H114O6 JNZLJJXCXKXIHT-XDOGSREESA-N -HMDB0048547 942.861541391 TG(16:1(9Z)/24:0/18:1(9Z)) C61H114O6 CSXWUPDTKWUFDD-JUFUZYQMSA-N -HMDB0048548 970.89284152 TG(16:1(9Z)/24:0/20:1(11Z)) C63H118O6 FNHNIQYRALAOKL-GCGFRPBCSA-N -HMDB0048549 966.861541391 TG(16:1(9Z)/24:0/20:3(5Z,8Z,11Z)) C63H114O6 ZNLDPPZYMIYAKR-MVMAAOOESA-N -HMDB0048552 940.845891326 TG(16:1(9Z)/24:0/18:2(9Z,12Z)) C61H112O6 SZWHHAMLCPVQHZ-WFESAASTSA-N -HMDB0048553 938.830241262 TG(16:1(9Z)/24:0/18:3(6Z,9Z,12Z)) C61H110O6 QZEYFZLPYNVHDI-JITPNZGCSA-N -HMDB0048554 968.877191455 TG(16:1(9Z)/24:0/20:2n6) C63H116O6 IKNAMSQXQLOJII-YQMKNMNOSA-N -HMDB0048555 966.861541391 TG(16:1(9Z)/24:0/20:3n6) C63H114O6 HEMRKPYNFGQFML-CWNCUYJFSA-N -HMDB0048556 964.845891326 TG(16:1(9Z)/24:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 YYVDCJLPCNWCCR-YOGIAVCXSA-N -HMDB0048560 938.830241262 TG(16:1(9Z)/24:0/18:3(9Z,12Z,15Z)) C61H110O6 QCFICBUSORBZMX-UVSJIQQOSA-N -HMDB0048562 964.845891326 TG(16:1(9Z)/24:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 KVBRKDKYGMSEEX-LXCNRSJASA-N -HMDB0048563 962.830241262 TG(16:1(9Z)/24:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 LXMOBIJJRVVOQR-KRQGKKBVSA-N -HMDB0048572 856.75199094 TG(16:1(9Z)/14:1(9Z)/22:1(13Z)) C55H100O6 BDWAIWYOHVLVMF-RUTWIJPDSA-N -HMDB0048573 884.783291069 TG(16:1(9Z)/14:1(9Z)/24:1(15Z)) C57H104O6 VLLWHKDCWQXIBL-FQVFIEMGSA-N -HMDB0048593 852.720690811 TG(16:1(9Z)/16:1(9Z)/20:3(5Z,8Z,11Z)) C55H96O6 LUNKFQMIUALALF-SSXZHBJOSA-N -HMDB0048594 884.783291069 TG(16:1(9Z)/16:1(9Z)/22:1(13Z)) C57H104O6 HJRVVCOWJQUKTM-GWYBQCJYSA-N -HMDB0048599 852.720690811 TG(16:1(9Z)/16:1(9Z)/20:3n6) C55H96O6 YLSQMGKHEUFXMJ-SXILZFAHSA-N -HMDB0048601 882.767641004 TG(16:1(9Z)/16:1(9Z)/22:2(13Z,16Z)) C57H102O6 YUBPSQNVVBRHKY-NYDKXWMXSA-N -HMDB0048612 856.75199094 TG(16:1(9Z)/18:1(11Z)/18:1(11Z)) C55H100O6 FVASQEUWMANRGF-KACSEKLOSA-N -HMDB0048613 856.75199094 TG(16:1(9Z)/18:1(11Z)/18:1(9Z)) C55H100O6 MGFTVBFRGRHBJX-NMARCYPWSA-N -HMDB0048614 884.783291069 TG(16:1(9Z)/18:1(11Z)/20:1(11Z)) C57H104O6 HVIQWNBZDUXPDM-LJQLTSPLSA-N -HMDB0048615 880.75199094 TG(16:1(9Z)/18:1(11Z)/20:3(5Z,8Z,11Z)) C57H100O6 JRNCFIBTWGMRER-XHYLUUIBSA-N -HMDB0048617 940.845891326 TG(16:1(9Z)/18:1(11Z)/24:1(15Z)) C61H112O6 OAYIGAFUEDTGGM-NVUSDZMUSA-N -HMDB0048618 854.736340876 TG(16:1(9Z)/18:1(11Z)/18:2(9Z,12Z)) C55H98O6 CREVCBCOPOOZEP-FJBDFYQDSA-N -HMDB0048619 852.720690811 TG(16:1(9Z)/18:1(11Z)/18:3(6Z,9Z,12Z)) C55H96O6 GJUYNZPMUHMLSD-CPBFSUFUSA-N -HMDB0048620 882.767641004 TG(16:1(9Z)/18:1(11Z)/20:2n6) C57H102O6 XTSQWTDQTZVALB-RLDWNXHBSA-N -HMDB0048621 880.75199094 TG(16:1(9Z)/18:1(11Z)/20:3n6) C57H100O6 ORNQRRXFGCNXPC-LGHBDGNLSA-N -HMDB0048626 852.720690811 TG(16:1(9Z)/18:1(11Z)/18:3(9Z,12Z,15Z)) C55H96O6 KDCKRLAPPIAVIP-KPKCWFFXSA-N -HMDB0048634 856.75199094 TG(16:1(9Z)/18:1(9Z)/18:1(11Z)) C55H100O6 FXVLQYFZVVLQJO-GDLLXJMDSA-N -HMDB0048637 880.75199094 TG(16:1(9Z)/18:1(9Z)/20:3(5Z,8Z,11Z)) C57H100O6 FJPOWCDSUMTJMY-HIGJHTSDSA-N -HMDB0048639 940.845891326 TG(16:1(9Z)/18:1(9Z)/24:1(15Z)) C61H112O6 OQYXMWZVMDPNIP-LTOBCQMGSA-N -HMDB0048641 852.720690811 TG(16:1(9Z)/18:1(9Z)/18:3(6Z,9Z,12Z)) C55H96O6 BTLLBFZSJPKPDE-MXDHFGQXSA-N -HMDB0048642 882.767641004 TG(16:1(9Z)/18:1(9Z)/20:2n6) C57H102O6 ONYOXARKNBCDOW-UDEYGTCASA-N -HMDB0048643 880.75199094 TG(16:1(9Z)/18:1(9Z)/20:3n6) C57H100O6 QXRVJZIWSZYNFE-XAAVOVOVSA-N -HMDB0048648 852.720690811 TG(16:1(9Z)/18:1(9Z)/18:3(9Z,12Z,15Z)) C55H96O6 CDPGTJRMESRMBM-HREIPWLJSA-N -HMDB0048655 856.751990932 TG(16:1(9Z)/20:1(11Z)/16:1(9Z)) C55H100O6 MONMKVNVVBWTKM-ULXWNTFBSA-N -HMDB0048656 884.783291069 TG(16:1(9Z)/20:1(11Z)/18:1(11Z)) C57H104O6 PXIRAQVGRSCHAE-LJQLTSPLSA-N -HMDB0048657 884.783291069 TG(16:1(9Z)/20:1(11Z)/18:1(9Z)) C57H104O6 BIPVSIKNOFBMKW-XYSPBAOWSA-N -HMDB0048660 940.845891326 TG(16:1(9Z)/20:1(11Z)/22:1(13Z)) C61H112O6 SFTJTIUAYCUEKQ-HGHZMINCSA-N -HMDB0048661 968.877191455 TG(16:1(9Z)/20:1(11Z)/24:1(15Z)) C63H116O6 WNUCOTRZBRFTHH-TZDGBVHQSA-N -HMDB0048662 882.767641004 TG(16:1(9Z)/20:1(11Z)/18:2(9Z,12Z)) C57H102O6 UKLOGABOYJJQSN-DPJFVPNFSA-N -HMDB0048663 880.75199094 TG(16:1(9Z)/20:1(11Z)/18:3(6Z,9Z,12Z)) C57H100O6 NAKJXCQFDQFGQP-MMLNGJMZSA-N -HMDB0048667 938.830241262 TG(16:1(9Z)/20:1(11Z)/22:2(13Z,16Z)) C61H110O6 RFURIDCRDPRIJL-CMFUBODHSA-N -HMDB0048670 880.75199094 TG(16:1(9Z)/20:1(11Z)/18:3(9Z,12Z,15Z)) C57H100O6 JSYBHNVWTXAJTA-DYGHEFCSSA-N -HMDB0048677 852.720690804 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/16:1(9Z)) C55H96O6 AUMXQCVFWSNALF-PMEIDYDXSA-N -HMDB0048678 880.75199094 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/18:1(11Z)) C57H100O6 HRCLBQUOANENCJ-NXKBWLDRSA-N -HMDB0048679 880.75199094 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/18:1(9Z)) C57H100O6 BRUKBMVWXMWLGD-BRFUKUAZSA-N -HMDB0048683 964.845891326 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/24:1(15Z)) C63H112O6 KGQWRGYSBBEKHB-WCSUGQLZSA-N -HMDB0048695 900.720690811 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 YKSVCFOMADIPHE-ZQVSYAHOSA-N -HMDB0048698 868.788376449 TG(16:1(9Z)/20:3(5Z,8Z,11Z)/o-18:0) C57H104O5 JTOXJDDZUMEKEU-MEZFIFTBSA-N -HMDB0048699 884.78329106 TG(16:1(9Z)/22:1(13Z)/16:1(9Z)) C57H104O6 DFMOOXJLNYMJDV-ULXWNTFBSA-N -HMDB0048702 940.845891326 TG(16:1(9Z)/22:1(13Z)/20:1(11Z)) C61H112O6 LKBYQEQTTQMXOC-HGHZMINCSA-N -HMDB0048704 968.877191455 TG(16:1(9Z)/22:1(13Z)/22:1(13Z)) C63H116O6 ZZBKGDIMYDDPOX-TZDGBVHQSA-N -HMDB0048708 938.830241262 TG(16:1(9Z)/22:1(13Z)/20:2n6) C61H110O6 RVCBRFVHTZWGMW-ASHUIHEYSA-N -HMDB0048711 966.861541391 TG(16:1(9Z)/22:1(13Z)/22:2(13Z,16Z)) C63H114O6 BOXFXXYECNCIFC-WWFHVJJSSA-N -HMDB0048712 962.830241262 TG(16:1(9Z)/22:1(13Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 CHXNIWLFFFQXQY-WJGYWGQGSA-N -HMDB0048719 958.798941133 TG(16:1(9Z)/22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 LXYLTKFBCPXRRN-HDIRYVEKSA-N -HMDB0048720 900.850976706 TG(16:1(9Z)/22:1(13Z)/o-18:0) C59H112O5 UCAVRBQATPCINL-WOQPDSBWSA-N -HMDB0048722 940.845891326 TG(16:1(9Z)/24:1(15Z)/18:1(11Z)) C61H112O6 STEWTUZWAFGDIQ-NVUSDZMUSA-N -HMDB0048723 940.845891326 TG(16:1(9Z)/24:1(15Z)/18:1(9Z)) C61H112O6 IDVKFTSFXLYDBH-LTOBCQMGSA-N -HMDB0048724 968.877191455 TG(16:1(9Z)/24:1(15Z)/20:1(11Z)) C63H116O6 AQYFFCAUDMUBEY-TZDGBVHQSA-N -HMDB0048725 964.845891326 TG(16:1(9Z)/24:1(15Z)/20:3(5Z,8Z,11Z)) C63H112O6 OXIPRMUYAGLPPY-ZYXFBPIPSA-N -HMDB0048728 938.830241262 TG(16:1(9Z)/24:1(15Z)/18:2(9Z,12Z)) C61H110O6 HQJQLIWBFMBNJL-KZRWCJBRSA-N -HMDB0048730 966.861541391 TG(16:1(9Z)/24:1(15Z)/20:2n6) C63H114O6 ZULRYZCUNGPAHY-BFNALKGSSA-N -HMDB0048731 964.845891326 TG(16:1(9Z)/24:1(15Z)/20:3n6) C63H112O6 PKTUULQXDIEYDT-IXCCZORYSA-N -HMDB0048732 962.830241262 TG(16:1(9Z)/24:1(15Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 MYSDZTIORDWFIW-NGIVGCJJSA-N -HMDB0048738 962.830241262 TG(16:1(9Z)/24:1(15Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 GCZJDCKDLSIPSW-FHYOPNKYSA-N -HMDB0048742 928.882276835 TG(16:1(9Z)/24:1(15Z)/o-18:0) C61H116O5 OXJWMXOKVXQQKX-JLSFSZCSSA-N -HMDB0048749 938.830241262 TG(16:1(9Z)/18:2(9Z,12Z)/24:1(15Z)) C61H110O6 SPGXNOUOYUPBSF-KZRWCJBRSA-N -HMDB0048752 880.75199094 TG(16:1(9Z)/18:2(9Z,12Z)/20:2n6) C57H100O6 PASRUCZTFLIYBM-VHWXVXHCSA-N -HMDB0048763 900.720690811 TG(16:1(9Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 NPWRXJYSKONMPV-SRVQGIHESA-N -HMDB0048764 842.772726384 TG(16:1(9Z)/18:2(9Z,12Z)/o-18:0) C55H102O5 ZJUJYFBFJFLODJ-PLBCZWSDSA-N -HMDB0048766 852.720690811 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/18:1(11Z)) C55H96O6 HJJGKDWWDQGJME-CKJOLKHOSA-N -HMDB0048767 852.720690811 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/18:1(9Z)) C55H96O6 XUOLMCLGWGLYGT-APUPBLNDSA-N -HMDB0048768 880.75199094 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/20:1(11Z)) C57H100O6 WXMOURHYAWKCON-SQKVJRQFSA-N -HMDB0048779 900.720690811 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 YSXJWNGVILWQDX-AVCRWDDHSA-N -HMDB0048784 900.720690811 TG(16:1(9Z)/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 XEVQMHZJFRSFOB-KAJSVWELSA-N -HMDB0048788 882.767641004 TG(16:1(9Z)/20:2n6/18:1(11Z)) C57H102O6 AWXBRFPKZQLDSI-RLDWNXHBSA-N -HMDB0048789 882.767641004 TG(16:1(9Z)/20:2n6/18:1(9Z)) C57H102O6 GARPFACGXFDLSO-UDEYGTCASA-N -HMDB0048792 938.830241262 TG(16:1(9Z)/20:2n6/22:1(13Z)) C61H110O6 JQBAEHAUBJDGSF-ASHUIHEYSA-N -HMDB0048793 966.861541391 TG(16:1(9Z)/20:2n6/24:1(15Z)) C63H114O6 ZUPXIIFMWPFTKM-BFNALKGSSA-N -HMDB0048794 880.75199094 TG(16:1(9Z)/20:2n6/18:2(9Z,12Z)) C57H100O6 VBUYAWOUEDDBBW-VHWXVXHCSA-N -HMDB0048808 870.804026513 TG(16:1(9Z)/20:2n6/o-18:0) C57H106O5 HMGFDNAQAKGKOT-HPLDLCQESA-N -HMDB0048809 852.720690804 TG(16:1(9Z)/20:3n6/16:1(9Z)) C55H96O6 HVCCNWVJBNTHRL-DAOTZBDISA-N -HMDB0048810 880.75199094 TG(16:1(9Z)/20:3n6/18:1(11Z)) C57H100O6 HKADKLQZXQXYER-LRTSRMLQSA-N -HMDB0048811 880.75199094 TG(16:1(9Z)/20:3n6/18:1(9Z)) C57H100O6 NRHVUGOGJJHYKY-DVKFFMGFSA-N -HMDB0048815 964.845891326 TG(16:1(9Z)/20:3n6/24:1(15Z)) C63H112O6 KMLLHGHUQWACBE-FBBDNOKLSA-N -HMDB0048827 900.720690811 TG(16:1(9Z)/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 VKYKIUHFHBYWIQ-WBLOQSKGSA-N -HMDB0048830 868.788376449 TG(16:1(9Z)/20:3n6/o-18:0) C57H104O5 PTGPQOIWPOHYSI-AHPWZIASSA-N -HMDB0048837 962.830241262 TG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/24:1(15Z)) C63H110O6 FFSBYDWZGXLHOR-ZIMBHKEYSA-N -HMDB0048848 900.720690811 TG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 IEMZZKBCGPBDKP-CWEVJLAESA-N -HMDB0048851 924.720690811 TG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 WHDYIBJFERAONB-SLMFPZSOSA-N -HMDB0048852 866.772726384 TG(16:1(9Z)/20:4(5Z,8Z,11Z,14Z)/o-18:0) C57H102O5 AHGKMUVICCTCFM-XJGXMFLQSA-N -HMDB0048853 882.767640996 TG(16:1(9Z)/22:2(13Z,16Z)/16:1(9Z)) C57H102O6 FLBFFPPBNOZWBA-BGWVPBAESA-N -HMDB0048856 938.830241262 TG(16:1(9Z)/22:2(13Z,16Z)/20:1(11Z)) C61H110O6 GRFDFSAMUSSDRA-CMFUBODHSA-N -HMDB0048858 966.861541391 TG(16:1(9Z)/22:2(13Z,16Z)/22:1(13Z)) C63H114O6 FMHGBFIQGMDKBC-BFNALKGSSA-N -HMDB0048865 964.845891326 TG(16:1(9Z)/22:2(13Z,16Z)/22:2(13Z,16Z)) C63H112O6 QETBIRGBJSNBME-MPCQGPNJSA-N -HMDB0048867 958.798941133 TG(16:1(9Z)/22:2(13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 ADSZQKQPUVZHRL-ULNWCINRSA-N -HMDB0048872 958.798941133 TG(16:1(9Z)/22:2(13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 GKWLUOVARMAZKA-UOHHMHFFSA-N -HMDB0048873 956.783291069 TG(16:1(9Z)/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 RECDMXVWMLBZBY-GFAYSUQHSA-N -HMDB0048880 962.830241262 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/22:1(13Z)) C63H110O6 KTSYFYGEYMWJBJ-ULGUCPNJSA-N -HMDB0048888 956.783291069 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 BTOBAOSWLQZTFQ-GVPZLZGYSA-N -HMDB0048889 954.767641004 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 HRONLDWOZFWEAB-KLVOIOIWSA-N -HMDB0048891 900.720690811 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 MORKMZKGDIIIBY-MNVCBLJSSA-N -HMDB0048894 954.767641004 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 DOETYUIYWRXHRJ-JYEHIATOSA-N -HMDB0048895 952.75199094 TG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 DQYVDSPZECGLKR-QTHMJOIUSA-N -HMDB0048905 900.720690811 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)) C59H96O6 KFAZITXLGUDPHA-ZMHLKARHSA-N -HMDB0048909 958.798941133 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:2(13Z,16Z)) C63H106O6 VFICNLJKIFKMLD-KSLLCSTHSA-N -HMDB0048910 954.767641004 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 HWAKFXXPMACHCN-RXHBPMBHSA-N -HMDB0048911 952.75199094 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 DFWFUERTQLGULG-LHMCCVTQSA-N -HMDB0048912 900.720690811 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C59H96O6 ZAIUAHMIZJWRPI-IKHVCVBUSA-N -HMDB0048915 924.720690811 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 STBZEPVDQQTJQY-XEJHRLJHSA-N -HMDB0048916 952.75199094 TG(16:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 HCOXAOVJODNXKR-QQWYGIRHSA-N -HMDB0048920 852.720690811 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/18:1(11Z)) C55H96O6 KHIGDHJAAJSAMT-DEFSSQSYSA-N -HMDB0048921 852.720690811 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/18:1(9Z)) C55H96O6 SBMGSPMUZLTYRO-DKVKFSAXSA-N -HMDB0048922 880.75199094 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:1(11Z)) C57H100O6 ITVZPSFYQXIRPA-DYGHEFCSSA-N -HMDB0048933 900.720690811 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 PTGPWEGIOWAQLD-CADKDOPRSA-N -HMDB0048938 900.720690811 TG(16:1(9Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 HYGBWSXRFZKWPT-NZLVLWAVSA-N -HMDB0048954 900.720690811 TG(16:1(9Z)/18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C59H96O6 SHCRBDGMFUJKHT-OWRCNMJSSA-N -HMDB0048962 838.741426256 TG(16:1(9Z)/18:4(6Z,9Z,12Z,15Z)/o-18:0) C55H98O5 BUIOKWYGCCSIHR-IGSOARKHSA-N -HMDB0048969 962.830241262 TG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/24:1(15Z)) C63H110O6 MXQGPSRZEDBAOD-NLHFJXCOSA-N -HMDB0048974 900.720690811 TG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 SHWWTBXHUVHNGT-ZQMQYPPLSA-N -HMDB0048980 900.720690811 TG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 VQLVXVCYSYIBGT-VXBCCVGUSA-N -HMDB0048983 924.720690811 TG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 ZGCGJLBXPCKHOS-GALCDWOWSA-N -HMDB0048984 866.772726384 TG(16:1(9Z)/20:4(8Z,11Z,14Z,17Z)/o-18:0) C57H102O5 QMXKKHSUBLMCBY-IIAASTAYSA-N -HMDB0048989 900.720690811 TG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3(5Z,8Z,11Z)) C59H96O6 JNHLCTFBNVEPGE-IKQMSQSISA-N -HMDB0048995 900.720690811 TG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6) C59H96O6 KTXCVHLICBKPGH-NZSINWCFSA-N -HMDB0048999 924.720690811 TG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C61H96O6 YKWQPKBPMIZKRY-FNWLPWPMSA-N -HMDB0049004 924.720690811 TG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 ABRDLWYBZGTCTL-XBPNRUQUSA-N -HMDB0049015 900.720690811 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(6Z,9Z,12Z)) C59H96O6 JFKSTJCBEDXQKN-PPOXFNLUSA-N -HMDB0049019 958.798941133 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)) C63H106O6 MVZLNTWQSMVSCH-FZRWNLIVSA-N -HMDB0049020 954.767641004 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 RZPLQHKENQFELH-XHYUVWMJSA-N -HMDB0049021 952.75199094 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 VFQVWRHDXMNZND-NQLZIQBXSA-N -HMDB0049022 900.720690811 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C59H96O6 PVBOVZWBGFRMPX-YNYUJYHNSA-N -HMDB0049025 924.720690811 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 ZGPVKACJWPEIIR-OILKAXGNSA-N -HMDB0049026 952.75199094 TG(16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 FBNGTCSJDMTOOZ-XKFIDWOSSA-N -HMDB0049034 958.798941133 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:1(13Z)) C63H106O6 AEDDMHLQFFOWDJ-WPRTYRIVSA-N -HMDB0049036 900.720690811 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)) C59H96O6 RXPNRICKBTZRQQ-MZPJDRBRSA-N -HMDB0049040 924.720690811 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C61H96O6 CVASUUQYQOXYSJ-FULWPQASSA-N -HMDB0049041 956.783291069 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)) C63H104O6 FXJCGDYWDDAGPZ-VYERSXOXSA-N -HMDB0049042 952.75199094 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C63H100O6 OFTAFMFOCJTPKP-TVWKUVFGSA-N -HMDB0049046 924.720690811 TG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C61H96O6 JYBNKTCMSXGTGD-DTZQEWFRSA-N -HMDB0049055 868.788376449 TG(16:1(9Z)/o-18:0/20:3(5Z,8Z,11Z)) C57H104O5 LNKHZBGNOPRSQH-HNFYWPACSA-N -HMDB0049056 900.850976706 TG(16:1(9Z)/o-18:0/22:1(13Z)) C59H112O5 OEZUXFLSEGCWIE-UJLKRNAFSA-N -HMDB0049057 928.882276835 TG(16:1(9Z)/o-18:0/24:1(15Z)) C61H116O5 FPWUJNGGVATCPT-DMHUCQSQSA-N -HMDB0049058 842.772726384 TG(16:1(9Z)/o-18:0/18:2(9Z,12Z)) C55H102O5 PSHWARYKXDUDSM-UWFRZUFNSA-N -HMDB0049060 870.804026513 TG(16:1(9Z)/o-18:0/20:2n6) C57H106O5 WXYYNUWVWHESOG-SETUNUADSA-N -HMDB0049061 868.788376449 TG(16:1(9Z)/o-18:0/20:3n6) C57H104O5 FPTNHTUUMDTEJR-YESDNOKMSA-N -HMDB0049062 866.772726384 TG(16:1(9Z)/o-18:0/20:4(5Z,8Z,11Z,14Z)) C57H102O5 NMFGLZJGDVTWFX-XHSZMQQESA-N -HMDB0049067 838.741426256 TG(16:1(9Z)/o-18:0/18:4(6Z,9Z,12Z,15Z)) C55H98O5 SSKQGMAHQBYKGA-HWFCSVFLSA-N -HMDB0049068 866.772726384 TG(16:1(9Z)/o-18:0/20:4(8Z,11Z,14Z,17Z)) C57H102O5 LNXIGBSVBNTNGO-RNSYOBJXSA-N -HMDB0049077 914.830241262 TG(18:1(11Z)/14:0/24:1(15Z)) C59H110O6 FCEBICVTRXFYLZ-FRHRWYISSA-N -HMDB0049080 856.75199094 TG(18:1(11Z)/14:0/20:2n6) C55H100O6 COWOCJLJJIQXGS-RFTPNAAMSA-N -HMDB0049082 852.720690811 TG(18:1(11Z)/14:0/20:4(5Z,8Z,11Z,14Z)) C55H96O6 WWCDEFDAYUEHDA-OKQKBTIDSA-N -HMDB0049083 884.783291069 TG(18:1(11Z)/14:0/22:2(13Z,16Z)) C57H104O6 CLRWKONSSADDAS-CGBZTZCNSA-N -HMDB0049084 880.75199094 TG(18:1(11Z)/14:0/22:4(7Z,10Z,13Z,16Z)) C57H100O6 NXOBVWVEMROHRA-WFLHAWLWSA-N -HMDB0049088 852.720690811 TG(18:1(11Z)/14:0/20:4(8Z,11Z,14Z,17Z)) C55H96O6 QQGXWCCPNYCUGW-BNDMSUNUSA-N -HMDB0049099 842.736340876 TG(18:1(11Z)/15:0/18:2(9Z,12Z)) C54H98O6 PIYNNEKPAVFCLZ-FSYTWVSBSA-N -HMDB0049104 898.798941133 TG(18:1(11Z)/15:0/22:2(13Z,16Z)) C58H106O6 DZYJOMOZYGTRHJ-HNBAGWGBSA-N -HMDB0049117 882.767641004 TG(18:1(11Z)/16:0/20:3(5Z,8Z,11Z)) C57H102O6 OUQVHWIIFCXSRJ-BXFOAEPDSA-N -HMDB0049118 914.830241262 TG(18:1(11Z)/16:0/22:1(13Z)) C59H110O6 KGCKCEDJXPOMSE-JSPVYFJMSA-N -HMDB0049119 942.861541391 TG(18:1(11Z)/16:0/24:1(15Z)) C61H114O6 QMUSPYPGMAYRTR-GKJJFOOMSA-N -HMDB0049122 884.783291069 TG(18:1(11Z)/16:0/20:2n6) C57H104O6 QURCKNKEXAUCID-VXLYYTGTSA-N -HMDB0049123 882.767641004 TG(18:1(11Z)/16:0/20:3n6) C57H102O6 GLBKLCZHEXMDML-GGGLHGFASA-N -HMDB0049129 852.720690811 TG(18:1(11Z)/16:0/18:4(6Z,9Z,12Z,15Z)) C55H96O6 ACPCBDGMDMCVRO-QOWKEDLHSA-N -HMDB0049130 880.75199094 TG(18:1(11Z)/16:0/20:4(8Z,11Z,14Z,17Z)) C57H100O6 NBXZHICDXWJXHJ-DOECFCCQSA-N -HMDB0049137 914.830241262 TG(18:1(11Z)/18:0/20:1(11Z)) C59H110O6 QFNUIDSUZKRNIE-RNVNXQLBSA-N -HMDB0049139 942.861541391 TG(18:1(11Z)/18:0/22:1(13Z)) C61H114O6 DDQPMPZGDGZDLB-JALZRBNSSA-N -HMDB0049140 970.89284152 TG(18:1(11Z)/18:0/24:1(15Z)) C63H118O6 ZKVCIPCWALLPQC-JFTSYQGJSA-N -HMDB0049142 882.767641004 TG(18:1(11Z)/18:0/18:3(6Z,9Z,12Z)) C57H102O6 AIJGPUXXVZKCOC-QRKCIAQMSA-N -HMDB0049146 940.845891326 TG(18:1(11Z)/18:0/22:2(13Z,16Z)) C61H112O6 HJLYLYOJMWMVLA-YJOVGJGPSA-N -HMDB0049149 882.767641004 TG(18:1(11Z)/18:0/18:3(9Z,12Z,15Z)) C57H102O6 BZAUSRZLPIJRHO-OYDPGXKPSA-N -HMDB0049150 880.75199094 TG(18:1(11Z)/18:0/18:4(6Z,9Z,12Z,15Z)) C57H100O6 DNMGYNOZYHVTMB-HGTYTGFRSA-N -HMDB0049155 874.835326642 TG(18:1(11Z)/18:0/o-18:0) C57H110O5 KJOJFBLODPQJLX-ORXJQOAGSA-N -HMDB0049156 914.830241252 TG(18:1(11Z)/20:0/18:1(11Z)) C59H110O6 MIAUUKZRJAXLRT-XFUYORNGSA-N -HMDB0049157 914.830241262 TG(18:1(11Z)/20:0/18:1(9Z)) C59H110O6 KMXCXZGPKXMYER-ZJHNNUDUSA-N -HMDB0049158 942.861541391 TG(18:1(11Z)/20:0/20:1(11Z)) C61H114O6 RMYOOEULFAUMKN-XURCBCPLSA-N -HMDB0049159 938.830241262 TG(18:1(11Z)/20:0/20:3(5Z,8Z,11Z)) C61H110O6 RUUBPRONLULDIJ-AIQBBPGJSA-N -HMDB0049160 970.89284152 TG(18:1(11Z)/20:0/22:1(13Z)) C63H118O6 BDNLTRKYOYVEEN-WCGXTGDWSA-N -HMDB0049164 940.845891326 TG(18:1(11Z)/20:0/20:2n6) C61H112O6 MCTZBSNODNYQBM-OEMAFOEQSA-N -HMDB0049165 938.830241262 TG(18:1(11Z)/20:0/20:3n6) C61H110O6 HYPRJUDAMZSDSL-YQEKJALISA-N -HMDB0049167 968.877191455 TG(18:1(11Z)/20:0/22:2(13Z,16Z)) C63H116O6 ZDRCFAZKFWDKNW-LTSCPUBNSA-N -HMDB0049168 964.845891326 TG(18:1(11Z)/20:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 UYEMGSOIPJXIHT-QUTOEGKMSA-N -HMDB0049169 962.830241262 TG(18:1(11Z)/20:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 GNQOPFBPJFYLEN-ZXZGDFTBSA-N -HMDB0049174 962.830241262 TG(18:1(11Z)/20:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 PNELOFAUJCQISE-CTDBYVDHSA-N -HMDB0049176 902.866626771 TG(18:1(11Z)/20:0/o-18:0) C59H114O5 UORVMJWANGGOMW-COAUFNLESA-N -HMDB0049177 942.86154138 TG(18:1(11Z)/22:0/18:1(11Z)) C61H114O6 RKIWUSSRNOMOHK-XFUYORNGSA-N -HMDB0049178 942.861541391 TG(18:1(11Z)/22:0/18:1(9Z)) C61H114O6 GFFLZJLHLVDXFE-LHKBXGIASA-N -HMDB0049179 970.89284152 TG(18:1(11Z)/22:0/20:1(11Z)) C63H118O6 CCPVIYZRYMYSQZ-YVGCHGTOSA-N -HMDB0049180 966.861541391 TG(18:1(11Z)/22:0/20:3(5Z,8Z,11Z)) C63H114O6 WSXKYZANGLDIKE-YZMOLHRRSA-N -HMDB0049183 940.845891326 TG(18:1(11Z)/22:0/18:2(9Z,12Z)) C61H112O6 UEZYCMFLJSEDEB-IUDYXZLCSA-N -HMDB0049184 938.830241262 TG(18:1(11Z)/22:0/18:3(6Z,9Z,12Z)) C61H110O6 LAGWHQFUVYNWQJ-LEVMJDGGSA-N -HMDB0049185 968.877191455 TG(18:1(11Z)/22:0/20:2n6) C63H116O6 PJUDTLQEZCEYBU-UOKIHHONSA-N -HMDB0049186 966.861541391 TG(18:1(11Z)/22:0/20:3n6) C63H114O6 KBTUAEPMBMZEAT-GJPADJMISA-N -HMDB0049187 964.845891326 TG(18:1(11Z)/22:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 GPRNIHMMZUKOCG-UJZJWDKFSA-N -HMDB0049191 938.830241262 TG(18:1(11Z)/22:0/18:3(9Z,12Z,15Z)) C61H110O6 UGOUYCBMFPBXOX-VKCGIOIVSA-N -HMDB0049193 964.845891326 TG(18:1(11Z)/22:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 ZGUXKEKZSSEOPN-GPMKWKPKSA-N -HMDB0049194 962.830241262 TG(18:1(11Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 WZCUNFYCFDLHNZ-FPOJOZEWSA-N -HMDB0049198 970.892841508 TG(18:1(11Z)/24:0/18:1(11Z)) C63H118O6 NZJOZQGTEOIRPE-XFUYORNGSA-N -HMDB0049199 970.89284152 TG(18:1(11Z)/24:0/18:1(9Z)) C63H118O6 ADBUUCLFUXNJAT-YNFXCUKVSA-N -HMDB0049204 968.877191455 TG(18:1(11Z)/24:0/18:2(9Z,12Z)) C63H116O6 OKYXKQWJBHHXBC-ZZLUDCBUSA-N -HMDB0049205 966.861541391 TG(18:1(11Z)/24:0/18:3(6Z,9Z,12Z)) C63H114O6 RVALMDYIOYYMPN-UDBROKPMSA-N -HMDB0049212 966.861541391 TG(18:1(11Z)/24:0/18:3(9Z,12Z,15Z)) C63H114O6 ZVECOVJZJMOJSN-XITMOLFCSA-N -HMDB0049213 964.845891326 TG(18:1(11Z)/24:0/18:4(6Z,9Z,12Z,15Z)) C63H112O6 AMXNXQFOJFMVAP-YGFWICIISA-N -HMDB0049218 958.929227028 TG(18:1(11Z)/24:0/o-18:0) C63H122O5 ZCWCOELIGJYADE-NYINCGHRSA-N -HMDB0049221 856.75199094 TG(18:1(11Z)/14:1(9Z)/20:1(11Z)) C55H100O6 SEJBPZVTMDKZMT-WWAUBUJQSA-N -HMDB0049222 852.720690811 TG(18:1(11Z)/14:1(9Z)/20:3(5Z,8Z,11Z)) C55H96O6 OYVIPANDVFEMEV-QNBZKHKPSA-N -HMDB0049223 884.783291069 TG(18:1(11Z)/14:1(9Z)/22:1(13Z)) C57H104O6 PPGYTWCQPFGHHF-QSCSLWOISA-N -HMDB0049228 852.720690811 TG(18:1(11Z)/14:1(9Z)/20:3n6) C55H96O6 OFXPDVFCVMOXOI-MWFUTKLXSA-N -HMDB0049230 882.767641004 TG(18:1(11Z)/14:1(9Z)/22:2(13Z,16Z)) C57H102O6 ISZIDYGJUZQXDR-PVVBFDGQSA-N -HMDB0049242 884.783291069 TG(18:1(11Z)/16:1(9Z)/20:1(11Z)) C57H104O6 NUQXGTMHWLBOFD-LJQLTSPLSA-N -HMDB0049243 880.75199094 TG(18:1(11Z)/16:1(9Z)/20:3(5Z,8Z,11Z)) C57H100O6 ITWXUAWJAMUWRI-DLWBBAJCSA-N -HMDB0049245 940.845891326 TG(18:1(11Z)/16:1(9Z)/24:1(15Z)) C61H112O6 KRNIAXVTJSTDFH-NVUSDZMUSA-N -HMDB0049247 852.720690811 TG(18:1(11Z)/16:1(9Z)/18:3(6Z,9Z,12Z)) C55H96O6 YOEDLSRYINEBNN-OQMRYGIWSA-N -HMDB0049248 882.767641004 TG(18:1(11Z)/16:1(9Z)/20:2n6) C57H102O6 XDWSGZHSFJBWFG-RLDWNXHBSA-N -HMDB0049249 880.75199094 TG(18:1(11Z)/16:1(9Z)/20:3n6) C57H100O6 VCTYSQSAXZXBBM-LRTSRMLQSA-N -HMDB0049254 852.720690811 TG(18:1(11Z)/16:1(9Z)/18:3(9Z,12Z,15Z)) C55H96O6 XLTVJSFXOMIXKW-AWMWDXGLSA-N -HMDB0049261 884.78329106 TG(18:1(11Z)/18:1(11Z)/18:1(11Z)) C57H104O6 JSSROPRCXOAGCW-BUTYCLJRSA-N -HMDB0049262 884.783291069 TG(18:1(11Z)/18:1(11Z)/18:1(9Z)) C57H104O6 MIZFXTLHUPLNGP-OGZJHMPXSA-N -HMDB0049263 912.814591198 TG(18:1(11Z)/18:1(11Z)/20:1(11Z)) C59H108O6 DVVVWSWPMOHCJM-JGQQAENPSA-N -HMDB0049265 940.845891326 TG(18:1(11Z)/18:1(11Z)/22:1(13Z)) C61H112O6 PBUZOPDSPGPOQS-GQUABPRLSA-N -HMDB0049266 968.877191455 TG(18:1(11Z)/18:1(11Z)/24:1(15Z)) C63H116O6 CPMVPDLVOWSSKE-WGLLDAOBSA-N -HMDB0049267 882.767641004 TG(18:1(11Z)/18:1(11Z)/18:2(9Z,12Z)) C57H102O6 WYYFGQDJMAHICF-UHUUDVPASA-N -HMDB0049268 880.75199094 TG(18:1(11Z)/18:1(11Z)/18:3(6Z,9Z,12Z)) C57H100O6 FZUGYVDDNAJZLF-MVORAUPMSA-N -HMDB0049272 938.830241262 TG(18:1(11Z)/18:1(11Z)/22:2(13Z,16Z)) C61H110O6 CESSZFUPJUMNNU-LENAZKICSA-N -HMDB0049275 880.75199094 TG(18:1(11Z)/18:1(11Z)/18:3(9Z,12Z,15Z)) C57H100O6 MWIGZNCBUJFLIL-DRSHPDLOSA-N -HMDB0049281 872.819676578 TG(18:1(11Z)/18:1(11Z)/o-18:0) C57H108O5 CLCQSBVFBLSNEE-HMVBVNKWSA-N -HMDB0049282 884.78329106 TG(18:1(11Z)/18:1(9Z)/18:1(11Z)) C57H104O6 DTTIGIZBXFQWNL-HWEFBQTHSA-N -HMDB0049283 884.783291069 TG(18:1(11Z)/18:1(9Z)/18:1(9Z)) C57H104O6 JOURDTSYZKYHFB-VPQNIYBTSA-N -HMDB0049284 912.814591198 TG(18:1(11Z)/18:1(9Z)/20:1(11Z)) C59H108O6 IKJIWAALGJUTLA-HJLQGWHBSA-N -HMDB0049286 940.845891326 TG(18:1(11Z)/18:1(9Z)/22:1(13Z)) C61H112O6 QDMDGODCZNNQBV-VMPXLESRSA-N -HMDB0049287 968.877191455 TG(18:1(11Z)/18:1(9Z)/24:1(15Z)) C63H116O6 CFASHVJHKJIKRY-RTBJBVGVSA-N -HMDB0049288 882.767641004 TG(18:1(11Z)/18:1(9Z)/18:2(9Z,12Z)) C57H102O6 RKPVLJWMLADBIO-GFLVZEJQSA-N -HMDB0049289 880.75199094 TG(18:1(11Z)/18:1(9Z)/18:3(6Z,9Z,12Z)) C57H100O6 APBGQGAQJLLFMC-TYRAJOABSA-N -HMDB0049293 938.830241262 TG(18:1(11Z)/18:1(9Z)/22:2(13Z,16Z)) C61H110O6 PQNHEABAEPMJMD-OKIOPPKUSA-N -HMDB0049296 880.75199094 TG(18:1(11Z)/18:1(9Z)/18:3(9Z,12Z,15Z)) C57H100O6 YWOLEUFHHASIAX-SQLBINDESA-N -HMDB0049302 872.819676578 TG(18:1(11Z)/18:1(9Z)/o-18:0) C57H108O5 MUVVSXKCOYPIJY-BAYWWFOLSA-N -HMDB0049305 940.845891326 TG(18:1(11Z)/20:1(11Z)/20:1(11Z)) C61H112O6 FTPZUXAMLKYSRC-HDSWPUJOSA-N -HMDB0049307 968.877191455 TG(18:1(11Z)/20:1(11Z)/22:1(13Z)) C63H116O6 NMGROZCBZQQOSP-UBYAYVOWSA-N -HMDB0049311 938.830241262 TG(18:1(11Z)/20:1(11Z)/20:2n6) C61H110O6 BZHLYVKHDLPQFD-VDDAXEPZSA-N -HMDB0049314 966.861541391 TG(18:1(11Z)/20:1(11Z)/22:2(13Z,16Z)) C63H114O6 FWPCKKOAEAIPKJ-RLLXGZCISA-N -HMDB0049315 962.830241262 TG(18:1(11Z)/20:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 MNFJIZPZFDFSHT-IZQQJYTASA-N -HMDB0049322 958.798941133 TG(18:1(11Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 GSHKNZZOMWCMJO-NAIBVRFTSA-N -HMDB0049323 900.850976706 TG(18:1(11Z)/20:1(11Z)/o-18:0) C59H112O5 LMFJKPBELSZHCE-BMOJGYJNSA-N -HMDB0049328 964.845891326 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:1(13Z)) C63H112O6 NZLWAKCEBADZQI-LGFMCLGJSA-N -HMDB0049335 962.830241262 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:2(13Z,16Z)) C63H110O6 WODOUFGUYBJSCG-HFMIBNQHSA-N -HMDB0049336 958.798941133 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 VHPUITUUEXRCGU-QKFSVKKZSA-N -HMDB0049337 956.783291069 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 JQVMDWCSJIMBFA-WQDRWNKCSA-N -HMDB0049342 956.783291069 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 IGHPWMZALJOYAV-JFJJIJHHSA-N -HMDB0049343 954.767641004 TG(18:1(11Z)/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 CRAIJEBCCMKULT-HPZSSEKQSA-N -HMDB0049345 940.845891316 TG(18:1(11Z)/22:1(13Z)/18:1(11Z)) C61H112O6 RSYHUYFRXBMMEW-ANKPWZAQSA-N -HMDB0049346 940.845891326 TG(18:1(11Z)/22:1(13Z)/18:1(9Z)) C61H112O6 GXHRHWLAWLLOCF-VMPXLESRSA-N -HMDB0049347 968.877191455 TG(18:1(11Z)/22:1(13Z)/20:1(11Z)) C63H116O6 NMJIAWZBGZFPMZ-UBYAYVOWSA-N -HMDB0049348 964.845891326 TG(18:1(11Z)/22:1(13Z)/20:3(5Z,8Z,11Z)) C63H112O6 BUVNBWSDDBJEIH-VCDULOKCSA-N -HMDB0049351 938.830241262 TG(18:1(11Z)/22:1(13Z)/18:2(9Z,12Z)) C61H110O6 XQLSSUQHKWUYMC-YZDRKDPZSA-N -HMDB0049353 966.861541391 TG(18:1(11Z)/22:1(13Z)/20:2n6) C63H114O6 DFPNCBSXNOPJHY-UAGWNSTESA-N -HMDB0049354 964.845891326 TG(18:1(11Z)/22:1(13Z)/20:3n6) C63H112O6 MXNYWQGAKRABHA-KWEWDBRHSA-N -HMDB0049355 962.830241262 TG(18:1(11Z)/22:1(13Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 IBRKGGWUQIZSKI-PWRWVGHHSA-N -HMDB0049361 962.830241262 TG(18:1(11Z)/22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 DDZGDBPXBWPREM-OZLYPPMKSA-N -HMDB0049365 928.882276835 TG(18:1(11Z)/22:1(13Z)/o-18:0) C61H116O5 ZNRJZRRGRJDRMD-QNSGHZAOSA-N -HMDB0049366 968.877191444 TG(18:1(11Z)/24:1(15Z)/18:1(11Z)) C63H116O6 JHWDCGVOVZRWAF-ANKPWZAQSA-N -HMDB0049367 968.877191455 TG(18:1(11Z)/24:1(15Z)/18:1(9Z)) C63H116O6 NNCFNVDCMOKBFC-RTBJBVGVSA-N -HMDB0049372 966.861541391 TG(18:1(11Z)/24:1(15Z)/18:2(9Z,12Z)) C63H114O6 CFGOOLOMBIOEGG-DPJMPHFLSA-N -HMDB0049373 964.845891326 TG(18:1(11Z)/24:1(15Z)/18:3(6Z,9Z,12Z)) C63H112O6 NVTGKNBTUCFOOC-PUXYSJNBSA-N -HMDB0049380 964.845891326 TG(18:1(11Z)/24:1(15Z)/18:3(9Z,12Z,15Z)) C63H112O6 RERKVVZYIAVMKL-JVPAGSFPSA-N -HMDB0049381 962.830241262 TG(18:1(11Z)/24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 OGZYWHBWXAJJRP-YHDAGPPLSA-N -HMDB0049386 956.913576964 TG(18:1(11Z)/24:1(15Z)/o-18:0) C63H120O5 PMFLTJZDQUHUAB-CNKHIDIQSA-N -HMDB0049387 882.767641004 TG(18:1(11Z)/18:2(9Z,12Z)/18:1(11Z)) C57H102O6 WQAWIGRUXVAAIX-KGDSFANMSA-N -HMDB0049388 882.767641004 TG(18:1(11Z)/18:2(9Z,12Z)/18:1(9Z)) C57H102O6 UKJDYVVYSNHIJH-DHRQPHFCSA-N -HMDB0049389 910.798941133 TG(18:1(11Z)/18:2(9Z,12Z)/20:1(11Z)) C59H106O6 GLMVCLWSBJJWTR-FZTGDDQJSA-N -HMDB0049391 938.830241262 TG(18:1(11Z)/18:2(9Z,12Z)/22:1(13Z)) C61H110O6 ODZGUPAQUQGEKA-MJECLYFESA-N -HMDB0049392 966.861541391 TG(18:1(11Z)/18:2(9Z,12Z)/24:1(15Z)) C63H114O6 RVZCIRATOLVRIA-MTSJKGKGSA-N -HMDB0049393 880.75199094 TG(18:1(11Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C57H100O6 WOPXUTZTLHAOFJ-QHANJALHSA-N -HMDB0049407 870.804026513 TG(18:1(11Z)/18:2(9Z,12Z)/o-18:0) C57H106O5 WUWDYQPFUONYLK-YNAMKCPRSA-N -HMDB0049408 880.751990932 TG(18:1(11Z)/18:3(6Z,9Z,12Z)/18:1(11Z)) C57H100O6 UMPQTCRVUAVQQI-PULYFOIOSA-N -HMDB0049409 880.75199094 TG(18:1(11Z)/18:3(6Z,9Z,12Z)/18:1(9Z)) C57H100O6 VHJVYLPSJSQQCX-KALFCKLISA-N -HMDB0049413 964.845891326 TG(18:1(11Z)/18:3(6Z,9Z,12Z)/24:1(15Z)) C63H112O6 CIQHDYHPBGLGRY-OWUYJZTJSA-N -HMDB0049425 900.720690811 TG(18:1(11Z)/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 DTSVNYMUJNAOOU-CPUTZPKCSA-N -HMDB0049428 868.788376449 TG(18:1(11Z)/18:3(6Z,9Z,12Z)/o-18:0) C57H104O5 JSUSEOMHUNJYLL-UQQXENLJSA-N -HMDB0049431 938.830241262 TG(18:1(11Z)/20:2n6/20:1(11Z)) C61H110O6 CWWUWOFQAROKCL-UQYZWSIXSA-N -HMDB0049433 966.861541391 TG(18:1(11Z)/20:2n6/22:1(13Z)) C63H114O6 AJOYUENGEJHXFT-UAGWNSTESA-N -HMDB0049440 964.845891326 TG(18:1(11Z)/20:2n6/22:2(13Z,16Z)) C63H112O6 UQXVRDHAZYQOSA-DOYZNESKSA-N -HMDB0049442 958.798941133 TG(18:1(11Z)/20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 XHZZGLXWFJMTMZ-ZJWVVZHGSA-N -HMDB0049447 958.798941133 TG(18:1(11Z)/20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 PFAOTZPCSYQOED-UNEUZNPLSA-N -HMDB0049448 956.783291069 TG(18:1(11Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 OQVOEILLAWEJJU-WBBOMUOZSA-N -HMDB0049454 964.845891326 TG(18:1(11Z)/20:3n6/22:1(13Z)) C63H112O6 JDJRCOJFDNTSGV-YSJNCNSWSA-N -HMDB0049461 962.830241262 TG(18:1(11Z)/20:3n6/22:2(13Z,16Z)) C63H110O6 WMGBXZPFBDGEGE-RYBKQSRMSA-N -HMDB0049462 958.798941133 TG(18:1(11Z)/20:3n6/22:4(7Z,10Z,13Z,16Z)) C63H106O6 FERRYQPGBTWCLI-CIAXCLBGSA-N -HMDB0049463 956.783291069 TG(18:1(11Z)/20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 QREKKIRJSWBZTL-UGXPLPJOSA-N -HMDB0049468 956.783291069 TG(18:1(11Z)/20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 NYIPWEDEDCENLJ-PMZJQWIUSA-N -HMDB0049469 954.767641004 TG(18:1(11Z)/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 FDBPCQBWBNZEDW-BQPYFUBOSA-N -HMDB0049475 962.830241262 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/22:1(13Z)) C63H110O6 XBGZGJVIPABSJH-WKCUXUPPSA-N -HMDB0049483 956.783291069 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 RXMYNXNZICUHSI-WTXFIHGPSA-N -HMDB0049484 954.767641004 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 AJRSKYARNMVHFT-FPQJVPRTSA-N -HMDB0049486 900.720690811 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 BNFYPGSVPNZPRA-GNTVYFFGSA-N -HMDB0049489 954.767641004 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 XPRIEXJXLXJFEI-GPDKHWIOSA-N -HMDB0049490 952.75199094 TG(18:1(11Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 HSALVDSITWQZNS-FENZPOJDSA-N -HMDB0049492 938.830241252 TG(18:1(11Z)/22:2(13Z,16Z)/18:1(11Z)) C61H110O6 FZKWULPGSLRZTH-UYTRXKGHSA-N -HMDB0049493 938.830241262 TG(18:1(11Z)/22:2(13Z,16Z)/18:1(9Z)) C61H110O6 AAYJVNROXHMWJF-OKIOPPKUSA-N -HMDB0049494 966.861541391 TG(18:1(11Z)/22:2(13Z,16Z)/20:1(11Z)) C63H114O6 GDWVKMUJAYQRMH-RLLXGZCISA-N -HMDB0049495 962.830241262 TG(18:1(11Z)/22:2(13Z,16Z)/20:3(5Z,8Z,11Z)) C63H110O6 FSUMMHYNEFRCKJ-RJATWLLBSA-N -HMDB0049500 964.845891326 TG(18:1(11Z)/22:2(13Z,16Z)/20:2n6) C63H112O6 OYFSLUROHDMBJJ-DOYZNESKSA-N -HMDB0049501 962.830241262 TG(18:1(11Z)/22:2(13Z,16Z)/20:3n6) C63H110O6 SRARWQZTRDRWIY-RLPWNCGFSA-N -HMDB0049509 958.798941133 TG(18:1(11Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 LQORAQJGEORWLS-MCWFOEECSA-N -HMDB0049512 926.866626771 TG(18:1(11Z)/22:2(13Z,16Z)/o-18:0) C61H114O5 JLHHWPUYZJHBEJ-BHNDFJEDSA-N -HMDB0049515 962.830241262 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:1(11Z)) C63H110O6 SYOMGTNMWHLBFV-NFUXPRKBSA-N -HMDB0049516 958.798941133 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)) C63H106O6 UDICYIUJKLODAB-HBCWWQHQSA-N -HMDB0049522 958.798941133 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:3n6) C63H106O6 IAFMACZCBGOYAR-SKZBEDAZSA-N -HMDB0049523 956.783291069 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 IIUYJEVBYIQITA-NNUSJQSTSA-N -HMDB0049529 956.783291069 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 UWOXYLRRGFBQMC-GBPORJMJSA-N -HMDB0049530 954.767641004 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 SBRTXDNWWVUJGY-GQYGFRRTSA-N -HMDB0049532 980.783291069 TG(18:1(11Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 ZDZGRFOKLODFJJ-DTKSAECMSA-N -HMDB0049537 956.783291069 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)) C63H104O6 BJLRZHNJFQMOIR-NMCZSGHLSA-N -HMDB0049542 958.798941133 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:2n6) C63H106O6 PFCDUEXIIFGNON-NMYFRQMXSA-N -HMDB0049543 956.783291069 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:3n6) C63H104O6 FHRLUJKJKYLPIE-QPYSUSQJSA-N -HMDB0049544 954.767641004 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 SPZFKKCPMIILSL-ZDCKVPJRSA-N -HMDB0049547 980.783291069 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 CPPRQORZWKTODT-LFQKTXPPSA-N -HMDB0049550 954.767641004 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 GHZFGSBSLITSMO-NAGUGYBUSA-N -HMDB0049551 952.75199094 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 SAHJXIOVXNXTQL-UXKOHQIASA-N -HMDB0049552 980.783291069 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 CRTLUTSDOWTFCK-QKDNGUHJSA-N -HMDB0049553 978.767641004 TG(18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 WMBVQZLMMZWHJG-CYMLIKQLSA-N -HMDB0049555 880.751990932 TG(18:1(11Z)/18:3(9Z,12Z,15Z)/18:1(11Z)) C57H100O6 YZOSLKYDCFWPCI-XWAWYEIZSA-N -HMDB0049556 880.75199094 TG(18:1(11Z)/18:3(9Z,12Z,15Z)/18:1(9Z)) C57H100O6 MRBGPFJGICLPKZ-HTUOTVJLSA-N -HMDB0049560 964.845891326 TG(18:1(11Z)/18:3(9Z,12Z,15Z)/24:1(15Z)) C63H112O6 YAVAVSMMSRUIQM-VJPYWOHBSA-N -HMDB0049572 900.720690811 TG(18:1(11Z)/18:3(9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 SJPXPPDFLZCAGK-DZTURHCRSA-N -HMDB0049575 868.788376449 TG(18:1(11Z)/18:3(9Z,12Z,15Z)/o-18:0) C57H104O5 RZDWVTRPHNHEBJ-PCSQJDSHSA-N -HMDB0049581 962.830241262 TG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/24:1(15Z)) C63H110O6 HLZUZYCNWDXIET-GRTVCVDRSA-N -HMDB0049586 900.720690811 TG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 XLBDBVTYZICFPC-RBQORJPZSA-N -HMDB0049592 900.720690811 TG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 SCJRWDPPOJUNPY-OMAOCIIASA-N -HMDB0049595 924.720690811 TG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 NMBWREWNBSVWGK-KRWGDDCXSA-N -HMDB0049596 866.772726384 TG(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)/o-18:0) C57H102O5 VFDSPTRIQXDNNU-UOHWBMRBSA-N -HMDB0049601 962.830241262 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/22:1(13Z)) C63H110O6 LZQXDMQLLSQLDI-UWADXPHTSA-N -HMDB0049609 956.783291069 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 TWDVZQIJTRNOQN-YIHJFQOPSA-N -HMDB0049610 954.767641004 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 NWTURLYIJSOABO-TZMPUXRDSA-N -HMDB0049612 900.720690811 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 HWIYVWGYVREDBV-IQNNOPNZSA-N -HMDB0049615 954.767641004 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 DRHZXOAXOIEMMY-YFBLPMCWSA-N -HMDB0049616 952.75199094 TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 GLVZNJVSGWGEOW-XLAJVQPUSA-N -HMDB0049625 900.720690811 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(6Z,9Z,12Z)) C59H96O6 NWWIMNVSUNRCOZ-VQSVBKIVSA-N -HMDB0049629 958.798941133 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) C63H106O6 TUXUSRKEZCBDLD-RGWBQLMMSA-N -HMDB0049630 954.767641004 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 KQHIUWHKRXQFTK-VMGYSLFXSA-N -HMDB0049631 952.75199094 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 GJZAKWNUCSDFIU-VTAQKUKXSA-N -HMDB0049632 900.720690811 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z)) C59H96O6 ZQYFPDFYJXJUJL-LYZDWMDLSA-N -HMDB0049635 924.720690811 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 BHNZVYBODMKEQT-SSUPLLPUSA-N -HMDB0049636 952.75199094 TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 NAGOEYAYRYTHKH-JGWPCJPLSA-N -HMDB0049642 956.783291069 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C63H104O6 GYCKKRXENHOTFF-GKTAFWSMSA-N -HMDB0049647 958.798941133 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:2n6) C63H106O6 ICXGNYXLZAKZKP-FFEAFRBDSA-N -HMDB0049648 956.783291069 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:3n6) C63H104O6 RDYPQHGKLGNVNR-ZXYKEFTISA-N -HMDB0049649 954.767641004 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 GLIIMTFLXXHIBR-ZDVGPOOSSA-N -HMDB0049652 980.783291069 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 XKLODESLCLIXEV-PSXUGWDYSA-N -HMDB0049655 954.767641004 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 GMVLULHDBJHRNL-RKINMUMBSA-N -HMDB0049656 952.75199094 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 FQYWDFDUCXHAEX-PNOINLTMSA-N -HMDB0049657 980.783291069 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 LRBIDJYFWXUQGA-ZSFFAGERSA-N -HMDB0049658 978.767641004 TG(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 LVFGCKMHIYKCGK-KPJQOHOXSA-N -HMDB0049662 958.798941133 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:1(11Z)) C63H106O6 INWPHLCORRPJIM-KJAIXDQISA-N -HMDB0049663 954.767641004 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)) C63H102O6 HVOSMRAPGYBTSZ-QNLGPDMTSA-N -HMDB0049668 956.783291069 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2n6) C63H104O6 HIGNKIDTFFNZDL-FSYKTYDQSA-N -HMDB0049669 954.767641004 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6) C63H102O6 ZTDMXZQXQOEXKZ-OPEXVSHCSA-N -HMDB0049670 952.75199094 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 HXQABWBASCQTOJ-FBDKKEFZSA-N -HMDB0049672 980.783291069 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 AKWRLSBPYGLHDM-ZWWWWMGCSA-N -HMDB0049673 978.767641004 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 TYDXDNLOHMRFIS-AJIDGHILSA-N -HMDB0049675 924.720690811 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 QQEYPDQDALZZPI-RVWGHYTBSA-N -HMDB0049676 952.75199094 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 JHSXEMRTWBYZRI-YBIWHIJFSA-N -HMDB0049678 978.767641004 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 PONZKPRWQCDCFJ-ALURWCTDSA-N -HMDB0049679 976.75199094 TG(18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 LIWGBSUBZQSLON-GBJKKVSNSA-N -HMDB0049683 900.850976706 TG(18:1(11Z)/o-18:0/20:1(11Z)) C59H112O5 OUUHBPIFIILUCA-JPPPTBPHSA-N -HMDB0049685 928.882276835 TG(18:1(11Z)/o-18:0/22:1(13Z)) C61H116O5 AVOGJLBZQNPISG-JHTVFDPBSA-N -HMDB0049686 956.913576964 TG(18:1(11Z)/o-18:0/24:1(15Z)) C63H120O5 LISACBAHGCRQCQ-KKYDTTANSA-N -HMDB0049687 870.804026513 TG(18:1(11Z)/o-18:0/18:2(9Z,12Z)) C57H106O5 PEJYXBAMEZPBAX-QIJLKOGJSA-N -HMDB0049688 868.788376449 TG(18:1(11Z)/o-18:0/18:3(6Z,9Z,12Z)) C57H104O5 OVZDGNXRQHXYRU-DKHQVFKZSA-N -HMDB0049692 926.866626771 TG(18:1(11Z)/o-18:0/22:2(13Z,16Z)) C61H114O5 FJIWLFYCFVEOMI-ABMSFDGSSA-N -HMDB0049695 868.788376449 TG(18:1(11Z)/o-18:0/18:3(9Z,12Z,15Z)) C57H104O5 PCTKCCIZPRJCIQ-UXYCMECVSA-N -HMDB0049696 866.772726384 TG(18:1(11Z)/o-18:0/18:4(6Z,9Z,12Z,15Z)) C57H102O5 JLRXETBUGMIPJK-SSFJOSMMSA-N -HMDB0049705 914.830241262 TG(18:1(9Z)/14:0/24:1(15Z)) C59H110O6 IFMFNZAUKDXUBS-XEFQVAJMSA-N -HMDB0049708 856.75199094 TG(18:1(9Z)/14:0/20:2n6) C55H100O6 ADOAWMSGAVKGKY-LOUZIDRQSA-N -HMDB0049711 884.783291069 TG(18:1(9Z)/14:0/22:2(13Z,16Z)) C57H104O6 QTMSSVDGQFTUGW-AILSCRDTSA-N -HMDB0049712 880.75199094 TG(18:1(9Z)/14:0/22:4(7Z,10Z,13Z,16Z)) C57H100O6 SHWUEDFQQXTCJE-BVQXJMJWSA-N -HMDB0049716 852.720690811 TG(18:1(9Z)/14:0/20:4(8Z,11Z,14Z,17Z)) C55H96O6 MGEAAPQRAKZVAR-DBTYPVFMSA-N -HMDB0049726 842.736340876 TG(18:1(9Z)/15:0/18:2(9Z,12Z)) C54H98O6 WZQHACRHKQJTGS-GBFVOJRPSA-N -HMDB0049731 898.798941133 TG(18:1(9Z)/15:0/22:2(13Z,16Z)) C58H106O6 AGEPNYPMOSCATG-WEYDMKCFSA-N -HMDB0049743 882.767641004 TG(18:1(9Z)/16:0/20:3(5Z,8Z,11Z)) C57H102O6 QEQZJVMDJZDGPY-FJBXZDKUSA-N -HMDB0049744 914.830241262 TG(18:1(9Z)/16:0/22:1(13Z)) C59H110O6 FNKCAFMYNGUZAU-ZFWLCYAFSA-N -HMDB0049745 942.861541391 TG(18:1(9Z)/16:0/24:1(15Z)) C61H114O6 ABSZNRZAXPIPNQ-YHAQPZLLSA-N -HMDB0049746 856.75199094 TG(18:1(9Z)/16:0/18:2(9Z,12Z)) C55H100O6 FSTOZAMDIJDRCH-RISKEULASA-N -HMDB0049748 884.783291069 TG(18:1(9Z)/16:0/20:2n6) C57H104O6 TYPSCZYHWXUNQD-HLYOSYIHSA-N -HMDB0049749 882.767641004 TG(18:1(9Z)/16:0/20:3n6) C57H102O6 XWUIEUCNKIBJAB-SSKDQPTCSA-N -HMDB0049750 880.75199094 TG(18:1(9Z)/16:0/20:4(5Z,8Z,11Z,14Z)) C57H100O6 WICODSUDRZUJKB-FFBDFEMSSA-N -HMDB0049755 852.720690811 TG(18:1(9Z)/16:0/18:4(6Z,9Z,12Z,15Z)) C55H96O6 MXFKCAQPYLTUMC-DUGBKBSISA-N -HMDB0049756 880.75199094 TG(18:1(9Z)/16:0/20:4(8Z,11Z,14Z,17Z)) C57H100O6 ZMONUYUAVAZYFU-MPZPZLFDSA-N -HMDB0049762 914.830241262 TG(18:1(9Z)/18:0/20:1(11Z)) C59H110O6 ZKCCURQELYISMZ-ZYDPFBNWSA-N -HMDB0049764 942.861541391 TG(18:1(9Z)/18:0/22:1(13Z)) C61H114O6 QFGOYGNOTBVZDL-FNHBVCHXSA-N -HMDB0049765 970.89284152 TG(18:1(9Z)/18:0/24:1(15Z)) C63H118O6 BGOSCAYGIGBWAZ-PXTDELHOSA-N -HMDB0049766 884.783291069 TG(18:1(9Z)/18:0/18:2(9Z,12Z)) C57H104O6 OCXMVEFWZCJXTP-FLTCGBKESA-N -HMDB0049767 882.767641004 TG(18:1(9Z)/18:0/18:3(6Z,9Z,12Z)) C57H102O6 UZBLVYUHSFGJIV-OJASTPSBSA-N -HMDB0049771 940.845891326 TG(18:1(9Z)/18:0/22:2(13Z,16Z)) C61H112O6 IFPSXJPVXFGDJF-DUKYPQHXSA-N -HMDB0049775 880.75199094 TG(18:1(9Z)/18:0/18:4(6Z,9Z,12Z,15Z)) C57H100O6 XWWHTVUODKLIIT-GZJUGHSNSA-N -HMDB0049780 874.835326642 TG(18:1(9Z)/18:0/o-18:0) C57H110O5 PUKJHNUKDAALMG-OVDKEJHLSA-N -HMDB0049781 914.830241252 TG(18:1(9Z)/20:0/18:1(9Z)) C59H110O6 LDVWBXGIAOXJKP-VUGPWPOLSA-N -HMDB0049783 938.830241262 TG(18:1(9Z)/20:0/20:3(5Z,8Z,11Z)) C61H110O6 KLPBKIYPIXLUIY-XNXOMPFUSA-N -HMDB0049784 970.89284152 TG(18:1(9Z)/20:0/22:1(13Z)) C63H118O6 WZWIOTYITIUOCJ-IZQICMPYSA-N -HMDB0049788 940.845891326 TG(18:1(9Z)/20:0/20:2n6) C61H112O6 WAZXBESWUFNIKC-XIRNAJJQSA-N -HMDB0049789 938.830241262 TG(18:1(9Z)/20:0/20:3n6) C61H110O6 PTJRQGPURCBISX-WXXIOODTSA-N -HMDB0049791 968.877191455 TG(18:1(9Z)/20:0/22:2(13Z,16Z)) C63H116O6 YNHHZPAROZOHCY-VQWJJQQVSA-N -HMDB0049792 964.845891326 TG(18:1(9Z)/20:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 BHETTXDAZXCFKF-FKMGPEFTSA-N -HMDB0049793 962.830241262 TG(18:1(9Z)/20:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 FIEHEEYBLZIFLG-GRHYHTISSA-N -HMDB0049798 962.830241262 TG(18:1(9Z)/20:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 BOHGMMGUVPUWFF-WEMJJBFYSA-N -HMDB0049800 902.866626771 TG(18:1(9Z)/20:0/o-18:0) C59H114O5 GOMDFFGKASVPBQ-LKKPSHJRSA-N -HMDB0049801 942.86154138 TG(18:1(9Z)/22:0/18:1(9Z)) C61H114O6 GQNCOCJLEFUUME-VBZQPFBYSA-N -HMDB0049802 970.89284152 TG(18:1(9Z)/22:0/20:1(11Z)) C63H118O6 DWPNGNRTDXKEOG-QSCXPPFOSA-N -HMDB0049803 966.861541391 TG(18:1(9Z)/22:0/20:3(5Z,8Z,11Z)) C63H114O6 AOUHOSSCVUKSAD-ALEQAAMJSA-N -HMDB0049806 940.845891326 TG(18:1(9Z)/22:0/18:2(9Z,12Z)) C61H112O6 IHFWXPSVLCAYTA-NSOUBCFQSA-N -HMDB0049807 938.830241262 TG(18:1(9Z)/22:0/18:3(6Z,9Z,12Z)) C61H110O6 UCHSMZOZHHHKTN-XAHZAFGXSA-N -HMDB0049808 968.877191455 TG(18:1(9Z)/22:0/20:2n6) C63H116O6 KGLCIQWPEJNTLF-MPTAIMNVSA-N -HMDB0049809 966.861541391 TG(18:1(9Z)/22:0/20:3n6) C63H114O6 PFBXBGIBHLCMFX-OCGDWDBGSA-N -HMDB0049810 964.845891326 TG(18:1(9Z)/22:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 LMGNSHHFYGGMOJ-OTNUYYLHSA-N -HMDB0049814 938.830241262 TG(18:1(9Z)/22:0/18:3(9Z,12Z,15Z)) C61H110O6 MSUBTQPZOUPMQD-NVQONJOPSA-N -HMDB0049816 964.845891326 TG(18:1(9Z)/22:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 QZXIVAFCGWISDS-BKMKIOPFSA-N -HMDB0049817 962.830241262 TG(18:1(9Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 HAVPVXRAONEJBL-FUDXXLQYSA-N -HMDB0049821 970.892841508 TG(18:1(9Z)/24:0/18:1(9Z)) C63H118O6 OAJSPZUBFWYCCY-NNBGLWHGSA-N -HMDB0049826 968.877191455 TG(18:1(9Z)/24:0/18:2(9Z,12Z)) C63H116O6 ZRZVISWZVARYCM-QZWBWMDUSA-N -HMDB0049827 966.861541391 TG(18:1(9Z)/24:0/18:3(6Z,9Z,12Z)) C63H114O6 XMFRBOAHYIOZTK-SDNRSMOOSA-N -HMDB0049834 966.861541391 TG(18:1(9Z)/24:0/18:3(9Z,12Z,15Z)) C63H114O6 SEGAFXOOJWNDFX-NKNKUKIVSA-N -HMDB0049835 964.845891326 TG(18:1(9Z)/24:0/18:4(6Z,9Z,12Z,15Z)) C63H112O6 ZZTHPXVKEQEQDW-GLXVKYISSA-N -HMDB0049840 958.929227028 TG(18:1(9Z)/24:0/o-18:0) C63H122O5 KADMYKMUQFNYTD-KPUVNLRISA-N -HMDB0049842 856.75199094 TG(18:1(9Z)/14:1(9Z)/20:1(11Z)) C55H100O6 QBTDCDJQWFFVGF-GAAGLFOXSA-N -HMDB0049843 852.720690811 TG(18:1(9Z)/14:1(9Z)/20:3(5Z,8Z,11Z)) C55H96O6 SXSRTUPMLATBNN-WIKKIFFMSA-N -HMDB0049844 884.783291069 TG(18:1(9Z)/14:1(9Z)/22:1(13Z)) C57H104O6 PREDIUAQXWFUMA-JEQUJCETSA-N -HMDB0049849 852.720690811 TG(18:1(9Z)/14:1(9Z)/20:3n6) C55H96O6 NRVWPUNQTJDNID-BWMZTZCRSA-N -HMDB0049851 882.767641004 TG(18:1(9Z)/14:1(9Z)/22:2(13Z,16Z)) C57H102O6 YVYVTNJRAGMXOD-CPRBWVNASA-N -HMDB0049861 856.751990932 TG(18:1(9Z)/16:1(9Z)/18:1(9Z)) C55H100O6 VCABCCITBXMTKG-CABVQDRLSA-N -HMDB0049862 884.783291069 TG(18:1(9Z)/16:1(9Z)/20:1(11Z)) C57H104O6 PFIMEBGCGUJFNB-XYSPBAOWSA-N -HMDB0049863 880.75199094 TG(18:1(9Z)/16:1(9Z)/20:3(5Z,8Z,11Z)) C57H100O6 SRKCJTCWCCPZMA-ZNLZJBMVSA-N -HMDB0049865 940.845891326 TG(18:1(9Z)/16:1(9Z)/24:1(15Z)) C61H112O6 YEJRDTNJGBHPRE-LTOBCQMGSA-N -HMDB0049867 852.720690811 TG(18:1(9Z)/16:1(9Z)/18:3(6Z,9Z,12Z)) C55H96O6 XFZASIKJCCDVQE-ZBFKJNBGSA-N -HMDB0049868 882.767641004 TG(18:1(9Z)/16:1(9Z)/20:2n6) C57H102O6 MVWHBFFHLYXZJQ-UDEYGTCASA-N -HMDB0049869 880.75199094 TG(18:1(9Z)/16:1(9Z)/20:3n6) C57H100O6 CPINNDOHYCSUGR-DVKFFMGFSA-N -HMDB0049874 852.720690811 TG(18:1(9Z)/16:1(9Z)/18:3(9Z,12Z,15Z)) C55H96O6 ZEKFRROIYZYMJB-YUXMUTLDSA-N -HMDB0049882 912.814591198 TG(18:1(9Z)/18:1(11Z)/20:1(11Z)) C59H108O6 VEOVLFBKKMGGBT-PNSIWLCJSA-N -HMDB0049884 940.845891326 TG(18:1(9Z)/18:1(11Z)/22:1(13Z)) C61H112O6 PDJWMOMYSOZUKA-QLKRBTNSSA-N -HMDB0049885 968.877191455 TG(18:1(9Z)/18:1(11Z)/24:1(15Z)) C63H116O6 DJUZUKMVZZOHPA-YPSFEINCSA-N -HMDB0049887 880.75199094 TG(18:1(9Z)/18:1(11Z)/18:3(6Z,9Z,12Z)) C57H100O6 MSQGSTKKOSEGDB-FGYPPILCSA-N -HMDB0049891 938.830241262 TG(18:1(9Z)/18:1(11Z)/22:2(13Z,16Z)) C61H110O6 VJJRELRGCGHSSN-WUNIUEMGSA-N -HMDB0049894 880.75199094 TG(18:1(9Z)/18:1(11Z)/18:3(9Z,12Z,15Z)) C57H100O6 LBRUZFUQXUCAIU-GJPVFJSGSA-N -HMDB0049900 872.819676578 TG(18:1(9Z)/18:1(11Z)/o-18:0) C57H108O5 HOBVFWBPKZZJDS-CMEJSUTGSA-N -HMDB0049905 968.877191455 TG(18:1(9Z)/18:1(9Z)/24:1(15Z)) C63H116O6 PHZQINHSUNAFFE-YSOQIWIBSA-N -HMDB0049911 938.830241262 TG(18:1(9Z)/18:1(9Z)/22:2(13Z,16Z)) C61H110O6 MLHXDLRLDMFNPU-VPSBVNDRSA-N -HMDB0049920 872.819676578 TG(18:1(9Z)/18:1(9Z)/o-18:0) C57H108O5 OJWXCNKRIMWLSH-PAMRDINXSA-N -HMDB0049924 968.877191455 TG(18:1(9Z)/20:1(11Z)/22:1(13Z)) C63H116O6 AOIVCCSFBIWNFL-MEYRNFQCSA-N -HMDB0049928 938.830241262 TG(18:1(9Z)/20:1(11Z)/20:2n6) C61H110O6 ULBTVPHSXKRJBN-MWJFSITCSA-N -HMDB0049931 966.861541391 TG(18:1(9Z)/20:1(11Z)/22:2(13Z,16Z)) C63H114O6 NTSBPGZUJBXBSL-LNSYPENWSA-N -HMDB0049932 962.830241262 TG(18:1(9Z)/20:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 AKPFCWNOANKGPU-VBCVAJELSA-N -HMDB0049939 958.798941133 TG(18:1(9Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 YNFNQTHMVAZPPY-DKSTYILTSA-N -HMDB0049940 900.850976706 TG(18:1(9Z)/20:1(11Z)/o-18:0) C59H112O5 MWZGBHBJOPROOU-LFAHWVCXSA-N -HMDB0049944 964.845891326 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:1(13Z)) C63H112O6 AKQAUMVOMMKMTF-BZTMKZLJSA-N -HMDB0049951 962.830241262 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:2(13Z,16Z)) C63H110O6 XNFUACYEWNBQLH-MLXJOYFXSA-N -HMDB0049952 958.798941133 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 RBFZLZMJOWEYIX-RFDSRFODSA-N -HMDB0049953 956.783291069 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 VACJTARUJZHQTP-BYMLDMINSA-N -HMDB0049958 956.783291069 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 YCULQDJFVHNAEQ-HFOOQYDRSA-N -HMDB0049959 954.767641004 TG(18:1(9Z)/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 SDWMHLZEAPLCIQ-IVOGKTBOSA-N -HMDB0049961 940.845891316 TG(18:1(9Z)/22:1(13Z)/18:1(9Z)) C61H112O6 LQYKKZORBDYUKT-KDNOBURDSA-N -HMDB0049962 968.877191455 TG(18:1(9Z)/22:1(13Z)/20:1(11Z)) C63H116O6 OTXDGHXQYRYHDV-MEYRNFQCSA-N -HMDB0049963 964.845891326 TG(18:1(9Z)/22:1(13Z)/20:3(5Z,8Z,11Z)) C63H112O6 XODZXKPANKDXHP-FBVKJMAOSA-N -HMDB0049966 938.830241262 TG(18:1(9Z)/22:1(13Z)/18:2(9Z,12Z)) C61H110O6 COGBIGLYXFERSM-QKDFGVCKSA-N -HMDB0049968 966.861541391 TG(18:1(9Z)/22:1(13Z)/20:2n6) C63H114O6 OSQJHCZDNGROLT-UBCHDMNKSA-N -HMDB0049969 964.845891326 TG(18:1(9Z)/22:1(13Z)/20:3n6) C63H112O6 HWLVTNCWIOTLSO-SVXBYQQZSA-N -HMDB0049970 962.830241262 TG(18:1(9Z)/22:1(13Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 YXUAESIHENABSF-WUTBZMDUSA-N -HMDB0049976 962.830241262 TG(18:1(9Z)/22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 RYSFVHSTLPOBIB-PZLXZMQBSA-N -HMDB0049980 928.882276835 TG(18:1(9Z)/22:1(13Z)/o-18:0) C61H116O5 HTSDPTZQCYEEKC-SGRYFNBKSA-N -HMDB0049981 968.877191444 TG(18:1(9Z)/24:1(15Z)/18:1(9Z)) C63H116O6 YGGZFQWCIRKMIF-VVVJLKBJSA-N -HMDB0049986 966.861541391 TG(18:1(9Z)/24:1(15Z)/18:2(9Z,12Z)) C63H114O6 MIQNEBSSVNEWHY-VUCGYDTISA-N -HMDB0049987 964.845891326 TG(18:1(9Z)/24:1(15Z)/18:3(6Z,9Z,12Z)) C63H112O6 QTXQZWXXJFNSGW-AIYLCWKHSA-N -HMDB0049994 964.845891326 TG(18:1(9Z)/24:1(15Z)/18:3(9Z,12Z,15Z)) C63H112O6 PVXKEKCIFSZOTE-ONVKFWOQSA-N -HMDB0049995 962.830241262 TG(18:1(9Z)/24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 AQXPAPMULLSBQL-IASDWQFSSA-N -HMDB0050000 956.913576964 TG(18:1(9Z)/24:1(15Z)/o-18:0) C63H120O5 QIKLHWHYLOODPL-FFSMKODBSA-N -HMDB0050001 882.767641004 TG(18:1(9Z)/18:2(9Z,12Z)/18:1(9Z)) C57H102O6 UBFOEWXGSAZLKS-FVCHKXIASA-N -HMDB0050004 938.830241262 TG(18:1(9Z)/18:2(9Z,12Z)/22:1(13Z)) C61H110O6 ZIRJXTDTRZMNMW-ZXXNJQFSSA-N -HMDB0050005 966.861541391 TG(18:1(9Z)/18:2(9Z,12Z)/24:1(15Z)) C63H114O6 DSSFNWQQTMLKJD-FPVJMDJPSA-N -HMDB0050020 870.804026513 TG(18:1(9Z)/18:2(9Z,12Z)/o-18:0) C57H106O5 SNSCEPRATRYHSL-GBUKJYTBSA-N -HMDB0050021 880.751990932 TG(18:1(9Z)/18:3(6Z,9Z,12Z)/18:1(9Z)) C57H100O6 JMHHDSQNLZCCLT-YPDKBCJXSA-N -HMDB0050025 964.845891326 TG(18:1(9Z)/18:3(6Z,9Z,12Z)/24:1(15Z)) C63H112O6 ORQMNWAGMCHUBN-FKPJQCIFSA-N -HMDB0050037 900.720690811 TG(18:1(9Z)/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 NIYFCMHVCRSLEF-DRQOZWTKSA-N -HMDB0050040 868.788376449 TG(18:1(9Z)/18:3(6Z,9Z,12Z)/o-18:0) C57H104O5 YFWNVIUVILVVDR-KJXLAAIMSA-N -HMDB0050042 938.830241262 TG(18:1(9Z)/20:2n6/20:1(11Z)) C61H110O6 BKWZVJWHAPNDHG-VNTYJXFZSA-N -HMDB0050044 966.861541391 TG(18:1(9Z)/20:2n6/22:1(13Z)) C63H114O6 CZCNBEOJWUHLJB-UBCHDMNKSA-N -HMDB0050051 964.845891326 TG(18:1(9Z)/20:2n6/22:2(13Z,16Z)) C63H112O6 PIZKEXJUEDRGCV-SFKXYMDKSA-N -HMDB0050053 958.798941133 TG(18:1(9Z)/20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 MJNRQPAXIWANBB-VRHRGAFOSA-N -HMDB0050058 958.798941133 TG(18:1(9Z)/20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 UNPHSNFHDIZVSI-WAOWULNYSA-N -HMDB0050059 956.783291069 TG(18:1(9Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 YUCHRXJXJUSLFQ-WSUSZCAPSA-N -HMDB0050064 964.845891326 TG(18:1(9Z)/20:3n6/22:1(13Z)) C63H112O6 NHNBHJTVRJQCPP-FKDZCWOGSA-N -HMDB0050071 962.830241262 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TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6) C63H102O6 PEPRNBOWRGJCFH-WKWDPUHXSA-N -HMDB0050270 952.75199094 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 GUKADGOJBYUPGU-UNKSTFKMSA-N -HMDB0050272 980.783291069 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 YMGJAUNSLVNGOU-APJRUKJJSA-N -HMDB0050273 978.767641004 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 RUSGNCLMYHYYHV-CYOXCLDKSA-N -HMDB0050275 924.720690811 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 NWCRHTRUMSZHGL-TZENIUPZSA-N -HMDB0050276 952.75199094 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 HIHDUURHAHHFSF-FJFLLCHSSA-N -HMDB0050278 978.767641004 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 YEPSKQSRIFNCPW-TXVMANKGSA-N -HMDB0050279 976.75199094 TG(18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 PTACBPKQWASVGS-UGZZNBSXSA-N -HMDB0050282 900.850976706 TG(18:1(9Z)/o-18:0/20:1(11Z)) C59H112O5 OWYOMQRSVDVHPO-AUUXSCGFSA-N -HMDB0050284 928.882276835 TG(18:1(9Z)/o-18:0/22:1(13Z)) C61H116O5 GJNCCQAILGZQPE-LZXJXLBVSA-N -HMDB0050285 956.913576964 TG(18:1(9Z)/o-18:0/24:1(15Z)) C63H120O5 FRRIXNAAJYOQAA-AVIITVFHSA-N -HMDB0050286 870.804026513 TG(18:1(9Z)/o-18:0/18:2(9Z,12Z)) C57H106O5 TUHYVLFMYBFPEE-IJDLEHCASA-N -HMDB0050287 868.788376449 TG(18:1(9Z)/o-18:0/18:3(6Z,9Z,12Z)) C57H104O5 SXXIVYLKZBTODG-VKKPKEGASA-N -HMDB0050291 926.866626771 TG(18:1(9Z)/o-18:0/22:2(13Z,16Z)) C61H114O5 IAKNICPRAKVQME-IVTYRKPFSA-N -HMDB0050294 868.788376449 TG(18:1(9Z)/o-18:0/18:3(9Z,12Z,15Z)) C57H104O5 JLKCEKRVLYHNTR-KJNSHSROSA-N -HMDB0050295 866.772726384 TG(18:1(9Z)/o-18:0/18:4(6Z,9Z,12Z,15Z)) C57H102O5 JYMXJRDHIBKAPL-NKLSPBEBSA-N -HMDB0050301 882.767641004 TG(20:1(11Z)/14:0/20:3(5Z,8Z,11Z)) C57H102O6 SHYQNKZJLJXKPA-MJHHRUIBSA-N -HMDB0050302 914.830241262 TG(20:1(11Z)/14:0/22:1(13Z)) C59H110O6 LJLIFTYRIMZUNV-XWDCVAGASA-N -HMDB0050303 942.861541391 TG(20:1(11Z)/14:0/24:1(15Z)) C61H114O6 IGNHERGRXWPMJH-SUORVOMPSA-N -HMDB0050304 856.75199094 TG(20:1(11Z)/14:0/18:2(9Z,12Z)) C55H100O6 HAGMTXDICLFDOC-MMWLGPPDSA-N -HMDB0050306 884.783291069 TG(20:1(11Z)/14:0/20:2n6) C57H104O6 RKPJGADXZNHPGE-LCVXGRMFSA-N -HMDB0050307 882.767641004 TG(20:1(11Z)/14:0/20:3n6) C57H102O6 WUKREVVPLNPHSK-FKSNBECISA-N -HMDB0050308 880.75199094 TG(20:1(11Z)/14:0/20:4(5Z,8Z,11Z,14Z)) C57H100O6 SDKRXCCKVQOCAO-SOLHDMFPSA-N -HMDB0050313 852.720690811 TG(20:1(11Z)/14:0/18:4(6Z,9Z,12Z,15Z)) C55H96O6 LSFAIOBGARHDLM-UMBRLWILSA-N -HMDB0050314 880.75199094 TG(20:1(11Z)/14:0/20:4(8Z,11Z,14Z,17Z)) C57H100O6 FNZXUUOILKQHJU-APNJFMROSA-N -HMDB0050320 896.783291069 TG(20:1(11Z)/15:0/20:3(5Z,8Z,11Z)) C58H104O6 FGRFOAKBUFMFQQ-YVYSPMOKSA-N -HMDB0050325 898.798941133 TG(20:1(11Z)/15:0/20:2n6) C58H106O6 VGOGEYSPDFHEJZ-RGBKTUGCSA-N -HMDB0050326 896.783291069 TG(20:1(11Z)/15:0/20:3n6) C58H104O6 SOCNQOBFARPJBO-NVTXZIGUSA-N -HMDB0050338 914.830241252 TG(20:1(11Z)/16:0/20:1(11Z)) C59H110O6 LABRUJVSUYYTTA-LBXGSASVSA-N -HMDB0050340 942.861541391 TG(20:1(11Z)/16:0/22:1(13Z)) C61H114O6 LBXWNIAXYWLNFI-QWUUBBNBSA-N -HMDB0050341 970.89284152 TG(20:1(11Z)/16:0/24:1(15Z)) C63H118O6 JLQZYULPGPGUBH-UXCFDMNKSA-N -HMDB0050342 884.783291069 TG(20:1(11Z)/16:0/18:2(9Z,12Z)) C57H104O6 MWGRLUDJZRTHTP-YIECYNBOSA-N -HMDB0050343 882.767641004 TG(20:1(11Z)/16:0/18:3(6Z,9Z,12Z)) C57H102O6 QYLDVVKRGAXESB-QPPZUIHUSA-N -HMDB0050347 940.845891326 TG(20:1(11Z)/16:0/22:2(13Z,16Z)) C61H112O6 OZBDLYCKVSSLBL-GBEOITIKSA-N -HMDB0050350 882.767641004 TG(20:1(11Z)/16:0/18:3(9Z,12Z,15Z)) C57H102O6 YTADVVFTTOMNKE-YKXTZBHWSA-N -HMDB0050351 880.75199094 TG(20:1(11Z)/16:0/18:4(6Z,9Z,12Z,15Z)) C57H100O6 WQMRXKLRGJHYMP-JEVVKXRESA-N -HMDB0050356 874.835326642 TG(20:1(11Z)/16:0/o-18:0) C57H110O5 AYGOZGMOLWTELQ-DGWQIHMPSA-N -HMDB0050357 942.86154138 TG(20:1(11Z)/18:0/20:1(11Z)) C61H114O6 QOFVOYKNSFNVGG-RZEXXKRKSA-N -HMDB0050358 938.830241262 TG(20:1(11Z)/18:0/20:3(5Z,8Z,11Z)) C61H110O6 NIWWYTGJAYUGFA-PWKXCNRQSA-N -HMDB0050359 970.89284152 TG(20:1(11Z)/18:0/22:1(13Z)) C63H118O6 ZROXJHNMTWXXSU-HQBPBTHXSA-N -HMDB0050363 940.845891326 TG(20:1(11Z)/18:0/20:2n6) C61H112O6 OMWMADGRZUDBNS-NOEVCDAPSA-N -HMDB0050364 938.830241262 TG(20:1(11Z)/18:0/20:3n6) C61H110O6 JAPRMSLBZUSCAD-UPCBKKDWSA-N -HMDB0050366 968.877191455 TG(20:1(11Z)/18:0/22:2(13Z,16Z)) C63H116O6 QDWJAQSRCULWCC-VOZBUZFHSA-N -HMDB0050367 964.845891326 TG(20:1(11Z)/18:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 JOXVEMDPPLURBQ-DOEHVUJYSA-N -HMDB0050368 962.830241262 TG(20:1(11Z)/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 RXMAXLLPNKWYHJ-PVSLLAIASA-N -HMDB0050373 962.830241262 TG(20:1(11Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 ROEPCWTWFLVVNE-XUFMVWCYSA-N -HMDB0050375 902.866626771 TG(20:1(11Z)/18:0/o-18:0) C59H114O5 DNDQJEPSXBZSNW-DFOJIGQQSA-N -HMDB0050376 970.892841508 TG(20:1(11Z)/20:0/20:1(11Z)) C63H118O6 HIBOOXQOVDHKOV-RZEXXKRKSA-N -HMDB0050377 966.861541391 TG(20:1(11Z)/20:0/20:3(5Z,8Z,11Z)) C63H114O6 PQCPSTGNGBQVPR-IEWNCRJLSA-N -HMDB0050380 940.845891316 TG(20:1(11Z)/20:0/18:2(9Z,12Z)) C61H112O6 WYUNJFXMLHILJN-MSTBSTCSSA-N -HMDB0050381 938.830241262 TG(20:1(11Z)/20:0/18:3(6Z,9Z,12Z)) C61H110O6 VTOFANRVVFEBFP-VMHGLACNSA-N -HMDB0050382 968.877191455 TG(20:1(11Z)/20:0/20:2n6) C63H116O6 OOPMCEWTZJHXQW-NSCYWTOESA-N -HMDB0050383 966.861541391 TG(20:1(11Z)/20:0/20:3n6) C63H114O6 IDGIWWVXFKHRCG-JNOSERLFSA-N -HMDB0050384 964.845891326 TG(20:1(11Z)/20:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 UEUMJNZAUWBSAC-RDMJPJAWSA-N -HMDB0050388 938.830241262 TG(20:1(11Z)/20:0/18:3(9Z,12Z,15Z)) C61H110O6 KTHQCAZXMMMJNI-VSVWVITESA-N -HMDB0050390 964.845891326 TG(20:1(11Z)/20:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 YFMDCVKFNONJOO-HUOUOZGCSA-N -HMDB0050391 962.830241262 TG(20:1(11Z)/20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 YWMXFRKULOXAPT-MRGJCOISSA-N -HMDB0050399 968.877191455 TG(20:1(11Z)/22:0/18:2(9Z,12Z)) C63H116O6 XEGBEKAAVUQJRL-NYUYSZTLSA-N -HMDB0050400 966.861541391 TG(20:1(11Z)/22:0/18:3(6Z,9Z,12Z)) C63H114O6 FRAQRWVCMZTLGK-RGDGXKHXSA-N -HMDB0050407 966.861541391 TG(20:1(11Z)/22:0/18:3(9Z,12Z,15Z)) C63H114O6 UTZVSOSRMZACPL-ROPUVPJDSA-N -HMDB0050408 964.845891326 TG(20:1(11Z)/22:0/18:4(6Z,9Z,12Z,15Z)) C63H112O6 SAVXWGBSAALXPY-XUBHAFIFSA-N -HMDB0050413 958.929227028 TG(20:1(11Z)/22:0/o-18:0) C63H122O5 PQLKPQSCLYKAEF-SFTFLQKMSA-N -HMDB0050433 884.78329106 TG(20:1(11Z)/14:1(9Z)/20:1(11Z)) C57H104O6 AVDYVPMWQRDZRZ-JEDOZFSMSA-N -HMDB0050434 880.75199094 TG(20:1(11Z)/14:1(9Z)/20:3(5Z,8Z,11Z)) C57H100O6 JYSAOWHMYRNKSW-DLNVTLNRSA-N -HMDB0050436 940.845891326 TG(20:1(11Z)/14:1(9Z)/24:1(15Z)) C61H112O6 RBUWIFMTDWYJEN-KCPLLMEXSA-N -HMDB0050438 852.720690811 TG(20:1(11Z)/14:1(9Z)/18:3(6Z,9Z,12Z)) C55H96O6 YZEITGDSYFHHEK-AIUKGPHHSA-N -HMDB0050439 882.767641004 TG(20:1(11Z)/14:1(9Z)/20:2n6) C57H102O6 APYYLLXHUQMDDS-IQKRTTMSSA-N -HMDB0050440 880.75199094 TG(20:1(11Z)/14:1(9Z)/20:3n6) C57H100O6 MIFIJCHVVASRCZ-UMNWWONZSA-N -HMDB0050445 852.720690811 TG(20:1(11Z)/14:1(9Z)/18:3(9Z,12Z,15Z)) C55H96O6 KEGWRTMECYJUBP-LTASUQRYSA-N -HMDB0050454 940.845891326 TG(20:1(11Z)/16:1(9Z)/22:1(13Z)) C61H112O6 SIYFOTCMVVGGPK-HGHZMINCSA-N -HMDB0050455 968.877191455 TG(20:1(11Z)/16:1(9Z)/24:1(15Z)) C63H116O6 LZYPGVKOHKHDAD-TZDGBVHQSA-N -HMDB0050456 882.767641004 TG(20:1(11Z)/16:1(9Z)/18:2(9Z,12Z)) C57H102O6 XAHFVLNVNUAPSO-YJXCAZQISA-N -HMDB0050457 880.75199094 TG(20:1(11Z)/16:1(9Z)/18:3(6Z,9Z,12Z)) C57H100O6 OHIKEWGTVMTPFC-GFNRGQKQSA-N -HMDB0050461 938.830241262 TG(20:1(11Z)/16:1(9Z)/22:2(13Z,16Z)) C61H110O6 MEITWFTUQYDSIT-CMFUBODHSA-N -HMDB0050464 880.75199094 TG(20:1(11Z)/16:1(9Z)/18:3(9Z,12Z,15Z)) C57H100O6 HLXCIVKTQOCSJO-VOFAGOTGSA-N -HMDB0050471 940.845891316 TG(20:1(11Z)/18:1(11Z)/20:1(11Z)) C61H112O6 PIMPYDZIXKACMS-HGKIKGFLSA-N -HMDB0050473 968.877191455 TG(20:1(11Z)/18:1(11Z)/22:1(13Z)) C63H116O6 BTOBYBZBYYITRI-UBYAYVOWSA-N -HMDB0050477 938.830241262 TG(20:1(11Z)/18:1(11Z)/20:2n6) C61H110O6 BHMRNZLOEIYPSM-AZOPEHHSSA-N -HMDB0050480 966.861541391 TG(20:1(11Z)/18:1(11Z)/22:2(13Z,16Z)) C63H114O6 SLNSNTKFZUABKK-RLLXGZCISA-N -HMDB0050481 962.830241262 TG(20:1(11Z)/18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 AZCFJOQBPCTUJB-IZQQJYTASA-N -HMDB0050488 958.798941133 TG(20:1(11Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 VXEUWHHXKKJFHJ-NAIBVRFTSA-N -HMDB0050489 900.850976706 TG(20:1(11Z)/18:1(11Z)/o-18:0) C59H112O5 LQFACPSTFHEEKK-BMOJGYJNSA-N -HMDB0050490 940.845891316 TG(20:1(11Z)/18:1(9Z)/20:1(11Z)) C61H112O6 IFNVGGQCIPHTPE-CNZAGKLZSA-N -HMDB0050492 968.877191455 TG(20:1(11Z)/18:1(9Z)/22:1(13Z)) C63H116O6 IIVRPCVURYXRKJ-MEYRNFQCSA-N -HMDB0050496 938.830241262 TG(20:1(11Z)/18:1(9Z)/20:2n6) C61H110O6 UNXLYVQSTSVPKP-PNLGGNKPSA-N -HMDB0050499 966.861541391 TG(20:1(11Z)/18:1(9Z)/22:2(13Z,16Z)) C63H114O6 KYMZBLBKJMZRJX-LNSYPENWSA-N -HMDB0050500 962.830241262 TG(20:1(11Z)/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 WPTIBZNSPMSWML-VBCVAJELSA-N -HMDB0050507 958.798941133 TG(20:1(11Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 KPJGNTJVQXQHJJ-DKSTYILTSA-N -HMDB0050508 900.850976706 TG(20:1(11Z)/18:1(9Z)/o-18:0) C59H112O5 FEQGTAIRRDJZLL-LFAHWVCXSA-N -HMDB0050510 964.845891326 TG(20:1(11Z)/20:1(11Z)/20:3(5Z,8Z,11Z)) C63H112O6 NAZBWUYFIUKAKG-UJCIYMNTSA-N -HMDB0050513 938.830241252 TG(20:1(11Z)/20:1(11Z)/18:2(9Z,12Z)) C61H110O6 OYDPSWDUKLRDNF-PAILEEFFSA-N -HMDB0050515 966.861541391 TG(20:1(11Z)/20:1(11Z)/20:2n6) C63H114O6 IXONFDDCPAVLRA-JUCJSMHESA-N -HMDB0050516 964.845891326 TG(20:1(11Z)/20:1(11Z)/20:3n6) C63H112O6 YYDMKYRCWRXENW-RRZSHGKMSA-N -HMDB0050523 962.830241262 TG(20:1(11Z)/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 OJEKPAAJOOGLSW-UNMYWLFTSA-N -HMDB0050527 928.882276835 TG(20:1(11Z)/20:1(11Z)/o-18:0) C61H116O5 QZSMPWVATGOHPH-IRFFKQRJSA-N -HMDB0050528 964.845891316 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/20:1(11Z)) C63H112O6 SPCLMIMPBVSZFZ-YGHLKGMQSA-N -HMDB0050534 962.830241262 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/20:2n6) C63H110O6 QHLATCHOBPMICE-YATQAVBPSA-N -HMDB0050536 958.798941133 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 DMRCFTQNQMIGTD-IVCRIKDSSA-N -HMDB0050542 958.798941133 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 JRLHDZGAHDVBNN-APRDSBOISA-N -HMDB0050543 956.783291069 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 HTHXCXIQIAMNEI-LVHJIHQDSA-N -HMDB0050546 924.850976706 TG(20:1(11Z)/20:3(5Z,8Z,11Z)/o-18:0) C61H112O5 XGZIYXWMBQUNLC-ZIYYXOBBSA-N -HMDB0050551 966.861541391 TG(20:1(11Z)/22:1(13Z)/18:2(9Z,12Z)) C63H114O6 UBHZXNRDMRSIPS-HEARNLHVSA-N -HMDB0050552 964.845891326 TG(20:1(11Z)/22:1(13Z)/18:3(6Z,9Z,12Z)) C63H112O6 OZIVOOHFGACURK-ZQCAJQTISA-N -HMDB0050559 964.845891326 TG(20:1(11Z)/22:1(13Z)/18:3(9Z,12Z,15Z)) C63H112O6 AXZAPIACNHHVNU-PJTKLRLGSA-N -HMDB0050560 962.830241262 TG(20:1(11Z)/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 SPUJFJNWFPTYCI-XRXGBTCISA-N -HMDB0050565 956.913576964 TG(20:1(11Z)/22:1(13Z)/o-18:0) C63H120O5 AUNUZTMVWMIQKY-YIBOVCKLSA-N -HMDB0050585 938.830241262 TG(20:1(11Z)/18:2(9Z,12Z)/20:1(11Z)) C61H110O6 RYKBFFKZQHHFOA-GIKFAZOESA-N -HMDB0050587 966.861541391 TG(20:1(11Z)/18:2(9Z,12Z)/22:1(13Z)) C63H114O6 MQKXAZDGXABSQN-MAORRSLFSA-N -HMDB0050594 964.845891326 TG(20:1(11Z)/18:2(9Z,12Z)/22:2(13Z,16Z)) C63H112O6 QRQHIENJPWVWCM-DIROXVHGSA-N -HMDB0050596 958.798941133 TG(20:1(11Z)/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 KNVXBCMILXVLTA-SVPKEUKBSA-N -HMDB0050601 958.798941133 TG(20:1(11Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 BMSWKYPCZHQOJH-RBJHLLPSSA-N -HMDB0050602 956.783291069 TG(20:1(11Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 HATPVFYQRUFDTP-BMDPEGLOSA-N -HMDB0050606 964.845891326 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:1(13Z)) C63H112O6 IFRXOEIIKSFQOO-RDOOSSCFSA-N -HMDB0050613 962.830241262 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C63H110O6 CZCGMLNCRPSJDT-BMBDIIHYSA-N -HMDB0050614 958.798941133 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 RBASRMKCLNNORI-OCGPQTQRSA-N -HMDB0050615 956.783291069 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 CQPAGPNRJFQHMN-BUECDCDPSA-N -HMDB0050620 956.783291069 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 AILHDVOWAUJGKA-NBWVZTQDSA-N -HMDB0050621 954.767641004 TG(20:1(11Z)/18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 IHIIZCPGLXUXFB-KCMLPCOYSA-N -HMDB0050623 966.861541391 TG(20:1(11Z)/20:2n6/20:1(11Z)) C63H114O6 VQFVTSXDLUDVAR-FVCHKXIASA-N -HMDB0050624 962.830241262 TG(20:1(11Z)/20:2n6/20:3(5Z,8Z,11Z)) C63H110O6 OFRMFQDZUZWUCZ-PVTTXIDESA-N -HMDB0050629 964.845891326 TG(20:1(11Z)/20:2n6/20:2n6) C63H112O6 CTTAXJGEXQSTCM-MHDUNFFCSA-N -HMDB0050630 962.830241262 TG(20:1(11Z)/20:2n6/20:3n6) C63H110O6 ZZPHZVWOGZYNAO-FGVDUXSWSA-N -HMDB0050638 958.798941133 TG(20:1(11Z)/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 BZOZGDYJRRGPNI-DKZVVRBJSA-N -HMDB0050641 926.866626771 TG(20:1(11Z)/20:2n6/o-18:0) C61H114O5 JDPQRNIORXECGT-QJGJFOIQSA-N -HMDB0050642 964.845891316 TG(20:1(11Z)/20:3n6/20:1(11Z)) C63H112O6 JDVIBBNZDQDULN-YPDKBCJXSA-N -HMDB0050648 962.830241262 TG(20:1(11Z)/20:3n6/20:2n6) C63H110O6 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TG(20:1(11Z)/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 JKFVBYVUASWLNU-BHEDPJMFSA-N -HMDB0050773 952.75199094 TG(20:1(11Z)/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 UCHCSQUXSXHUED-UVPLAZAJSA-N -HMDB0050775 962.830241252 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:1(11Z)) C63H110O6 PRQIXVRXFROCMF-OFGRFLLGSA-N -HMDB0050776 958.798941133 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:3(5Z,8Z,11Z)) C63H106O6 XFQJFJLWOIVLOP-KSZJBMDGSA-N -HMDB0050782 958.798941133 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:3n6) C63H106O6 MHYXIAUVXQNGQB-GCOHTBHKSA-N -HMDB0050783 956.783291069 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 NLHGMVZOEGWXJR-QQYYTMJFSA-N -HMDB0050789 956.783291069 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 WBENLJREAPLIFI-GMYGOQFMSA-N -HMDB0050790 954.767641004 TG(20:1(11Z)/20:4(8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 CYFFZIAOTBPWJY-RZSYGCQESA-N -HMDB0050792 980.783291069 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TG(20:1(11Z)/o-18:0/20:3(5Z,8Z,11Z)) C61H112O5 BXABDUMCSIHFIE-DLQGIDGISA-N -HMDB0050853 956.913576964 TG(20:1(11Z)/o-18:0/22:1(13Z)) C63H120O5 NYVBOEBPAQPUMA-RRCUWGHESA-N -HMDB0050857 926.866626771 TG(20:1(11Z)/o-18:0/20:2n6) C61H114O5 PKYHAMJIVRQXKF-IUJIAQQVSA-N -HMDB0050858 924.850976706 TG(20:1(11Z)/o-18:0/20:3n6) C61H112O5 NYZDQWXRUMWJEF-PJQDDADQSA-N -HMDB0050860 954.8979269 TG(20:1(11Z)/o-18:0/22:2(13Z,16Z)) C63H118O5 JQFYUNTYJPUUBW-DELKLOGMSA-N -HMDB0050861 950.866626771 TG(20:1(11Z)/o-18:0/22:4(7Z,10Z,13Z,16Z)) C63H114O5 CRPGFZTUFREYFV-GEDGJZCPSA-N -HMDB0050862 948.850976706 TG(20:1(11Z)/o-18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H112O5 WDXAQMAKFLAOHN-FOHRYCQXSA-N -HMDB0050867 948.850976706 TG(20:1(11Z)/o-18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H112O5 OHDFRISQFVTZCL-ZVAJQFFRSA-N -HMDB0050871 938.830241262 TG(20:3(5Z,8Z,11Z)/14:0/24:1(15Z)) C61H110O6 GAQSYHGNKUYUAQ-GIICRSPRSA-N -HMDB0050872 852.720690811 TG(20:3(5Z,8Z,11Z)/14:0/18:2(9Z,12Z)) C55H96O6 CSHNWGMOFDDION-DFTHNFDESA-N -HMDB0050874 880.75199094 TG(20:3(5Z,8Z,11Z)/14:0/20:2n6) C57H100O6 TVFKBKZPDYIUEQ-TUUNMDAESA-N -HMDB0050885 900.720690811 TG(20:3(5Z,8Z,11Z)/14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 LSYRFXMMGSZPLP-VCRACHTMSA-N -HMDB0050886 842.772726384 TG(20:3(5Z,8Z,11Z)/14:0/o-18:0) C55H102O5 YSTMVIOAKCDXEL-CAMJIYRZSA-N -HMDB0050906 938.830241262 TG(20:3(5Z,8Z,11Z)/16:0/22:1(13Z)) C61H110O6 MVIQOCPGVCDPJO-AFLFQSMPSA-N -HMDB0050907 966.861541391 TG(20:3(5Z,8Z,11Z)/16:0/24:1(15Z)) C63H114O6 QCRGSRJHSCHLOD-HOODNAODSA-N -HMDB0050908 880.75199094 TG(20:3(5Z,8Z,11Z)/16:0/18:2(9Z,12Z)) C57H100O6 AMYBBMIDIXFAAQ-ASRHAWKCSA-N -HMDB0050922 870.804026513 TG(20:3(5Z,8Z,11Z)/16:0/o-18:0) C57H106O5 TYZDMXCEMORABR-XKSOYUSWSA-N -HMDB0050924 966.861541391 TG(20:3(5Z,8Z,11Z)/18:0/22:1(13Z)) C63H114O6 AONZFAXPHFTHIO-KUIHNVKKSA-N -HMDB0050931 964.845891326 TG(20:3(5Z,8Z,11Z)/18:0/22:2(13Z,16Z)) C63H112O6 LHTAXCCUUDIJJC-LVZFOJSQSA-N -HMDB0050933 958.798941133 TG(20:3(5Z,8Z,11Z)/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 GPZNPRSWWAGAKP-COYAEVMUSA-N -HMDB0050938 958.798941133 TG(20:3(5Z,8Z,11Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 ABQXBTBXGFBZIV-VZPWGZFTSA-N -HMDB0050939 956.783291069 TG(20:3(5Z,8Z,11Z)/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 IALRONIRWRXXFJ-LLIZJPEJSA-N -HMDB0050941 962.830241252 TG(20:3(5Z,8Z,11Z)/20:0/20:3(5Z,8Z,11Z)) C63H110O6 XHEAJMDJLPMZEK-CRDXHJEPSA-N -HMDB0050946 964.845891326 TG(20:3(5Z,8Z,11Z)/20:0/20:2n6) C63H112O6 LKMYGIJKNMNLDQ-AWKIPFIXSA-N -HMDB0050947 962.830241262 TG(20:3(5Z,8Z,11Z)/20:0/20:3n6) C63H110O6 UAJDOZFIHLGIOJ-HFXNBUSZSA-N -HMDB0050955 958.798941133 TG(20:3(5Z,8Z,11Z)/20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 BBGDVLRKNFSFTF-MAYGPMTGSA-N -HMDB0050958 926.866626771 TG(20:3(5Z,8Z,11Z)/20:0/o-18:0) C61H114O5 ZYGIRJGVMNSFKT-VFADWVNGSA-N -HMDB0050962 964.845891326 TG(20:3(5Z,8Z,11Z)/22:0/18:2(9Z,12Z)) C63H112O6 ANGCSMRUARXHTN-WZGMWKSFSA-N -HMDB0050963 962.830241262 TG(20:3(5Z,8Z,11Z)/22:0/18:3(6Z,9Z,12Z)) C63H110O6 UHDCEJARBRUIDB-NZNUNPNBSA-N -HMDB0050970 962.830241262 TG(20:3(5Z,8Z,11Z)/22:0/18:3(9Z,12Z,15Z)) C63H110O6 OSSYIJMBFKKOMK-HFQLDRFKSA-N -HMDB0050976 954.8979269 TG(20:3(5Z,8Z,11Z)/22:0/o-18:0) C63H118O5 RYAUACKFYWJJEY-SZPOQHLJSA-N -HMDB0051005 900.720690811 TG(20:3(5Z,8Z,11Z)/14:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 QZQJDOWDQQNPNJ-ARKGNJADSA-N -HMDB0051010 900.720690811 TG(20:3(5Z,8Z,11Z)/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 AEIYVURNZPSTRI-YGACXUFVSA-N -HMDB0051015 964.845891326 TG(20:3(5Z,8Z,11Z)/16:1(9Z)/24:1(15Z)) C63H112O6 ZNDLKGOPISOCOU-LAUYFDRRSA-N -HMDB0051027 900.720690811 TG(20:3(5Z,8Z,11Z)/16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 WJLTVCYAAPDLHN-BVBLATKGSA-N -HMDB0051030 868.788376449 TG(20:3(5Z,8Z,11Z)/16:1(9Z)/o-18:0) C57H104O5 BUUOSXNVBINTDM-DIOVRTRQSA-N -HMDB0051032 964.845891326 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:1(13Z)) C63H112O6 JIAJTOHVOZEPJW-WWJPPPJVSA-N -HMDB0051039 962.830241262 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:2(13Z,16Z)) C63H110O6 XWBXEKHMDWEGSR-DTHGWXTRSA-N -HMDB0051040 958.798941133 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 VUABVSDTWKAGBK-IPLKSACCSA-N -HMDB0051041 956.783291069 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 SPIHSNCGRXGHRO-SMSDKZIZSA-N -HMDB0051046 956.783291069 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 UYCTVQQBNMEKIQ-NFXPMROUSA-N -HMDB0051047 954.767641004 TG(20:3(5Z,8Z,11Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 YTJVEHDHQJQWGG-JWYHTXHQSA-N -HMDB0051050 964.845891326 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:1(13Z)) C63H112O6 ULRKYPIVIHSCGJ-ZYCSCMNVSA-N -HMDB0051057 962.830241262 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:2(13Z,16Z)) C63H110O6 DBOXIHBAINITHH-WMSBSANISA-N -HMDB0051058 958.798941133 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 SXPQPXRSBLSSAC-CXBYFZKBSA-N -HMDB0051059 956.783291069 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 PFLHGEYNZZRPBP-PPOZKYPFSA-N -HMDB0051064 956.783291069 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 SSPNCRHVPPGOSG-LLXLJNMZSA-N -HMDB0051065 954.767641004 TG(20:3(5Z,8Z,11Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 WNTXQOREERQHJA-NECXREMISA-N -HMDB0051072 962.830241262 TG(20:3(5Z,8Z,11Z)/20:1(11Z)/20:2n6) C63H110O6 KHTCDNIANMRTHD-CBFJKXGMSA-N -HMDB0051074 958.798941133 TG(20:3(5Z,8Z,11Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 FNVXDAXZGGBYJV-FAKGREKGSA-N -HMDB0051080 958.798941133 TG(20:3(5Z,8Z,11Z)/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 PYHYTXIIXWEHSC-XWNCALLUSA-N -HMDB0051081 956.783291069 TG(20:3(5Z,8Z,11Z)/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 BINYJEJVCIPSFI-ZEIIWBPJSA-N -HMDB0051084 924.850976706 TG(20:3(5Z,8Z,11Z)/20:1(11Z)/o-18:0) C61H112O5 GCRBDMOHZRWTQB-DLQGIDGISA-N -HMDB0051085 956.78329106 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)) C63H104O6 XWDKUUOKCJGHBE-RTQNNJNFSA-N -HMDB0051090 958.798941133 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:2n6) C63H106O6 BWXJGGJFPJYWNA-SXRRXPAXSA-N -HMDB0051091 956.783291069 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:3n6) C63H104O6 PEIWINCKWDTWRA-UPFOJVNOSA-N -HMDB0051092 954.767641004 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 YCOZIWGZFLMTFA-OUROJBLNSA-N -HMDB0051095 980.783291069 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 GOMWYYIOHUUNDY-DWUFDDORSA-N -HMDB0051098 954.767641004 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 DHAQDRDVKDGNJH-LAHJCCLASA-N -HMDB0051099 952.75199094 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 CDGBKFWHRXPNIS-ORLBESOTSA-N -HMDB0051100 980.783291069 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 RAEGSWCAOPPSJQ-UVBCVTSLSA-N -HMDB0051101 978.767641004 TG(20:3(5Z,8Z,11Z)/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 NGIXVWBHYCBVSU-KWSDDCTPSA-N -HMDB0051106 962.830241262 TG(20:3(5Z,8Z,11Z)/22:1(13Z)/18:2(9Z,12Z)) C63H110O6 HYQDCVGUIPYREC-CTWKOWSJSA-N -HMDB0051115 958.798941133 TG(20:3(5Z,8Z,11Z)/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 LKEFQOSBUFGTFE-KBLHDZGZSA-N -HMDB0051120 952.882276835 TG(20:3(5Z,8Z,11Z)/22:1(13Z)/o-18:0) C63H116O5 ZWNLCOBYNICJOK-GKEXURIISA-N -HMDB0051140 962.830241262 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/22:1(13Z)) C63H110O6 FFVISGZUNRMRSS-GBRJBTATSA-N -HMDB0051148 956.783291069 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 KIJAVMZBMCLIEW-OGMVDTFRSA-N -HMDB0051149 954.767641004 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 QCIVLXQVYGLERQ-YSISNIMRSA-N -HMDB0051151 900.720690811 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 HNCSGYNWTZTAKF-KDYXFAGWSA-N -HMDB0051154 954.767641004 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 SVBUNVHEBALJFL-MUVWSPMXSA-N -HMDB0051155 952.75199094 TG(20:3(5Z,8Z,11Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 LTMMYRYQSSNANI-GUDQXNRESA-N -HMDB0051161 900.720690811 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)) C59H96O6 JHBQRHHIBFVBER-YCNPISPFSA-N -HMDB0051165 958.798941133 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C63H106O6 CANUGJFNUXQJNT-FGHNRAHXSA-N -HMDB0051166 954.767641004 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 IIFYGJBPANGSOD-MNKQRYLNSA-N -HMDB0051167 952.75199094 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 DOVUUWKFUZDTOP-NEVHFMIHSA-N -HMDB0051168 900.720690811 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)) C59H96O6 KBDOPVRVUZKPQY-ZUKUAAGZSA-N -HMDB0051171 924.720690811 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 XMVHZFQXXQHPFZ-WRDFVJMZSA-N -HMDB0051172 952.75199094 TG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 JBOWPSIDPCYDPQ-KGALQOPBSA-N -HMDB0051175 958.798941133 TG(20:3(5Z,8Z,11Z)/20:2n6/20:3(5Z,8Z,11Z)) C63H106O6 CFDDNXGICWHOFE-GDGOABOLSA-N -HMDB0051181 958.798941133 TG(20:3(5Z,8Z,11Z)/20:2n6/20:3n6) C63H106O6 QJHAAKMJLURPNY-ROWHQPMDSA-N -HMDB0051182 956.783291069 TG(20:3(5Z,8Z,11Z)/20:2n6/20:4(5Z,8Z,11Z,14Z)) C63H104O6 AWUSALQTKNQHQD-NULDZOPGSA-N -HMDB0051188 956.783291069 TG(20:3(5Z,8Z,11Z)/20:2n6/20:4(8Z,11Z,14Z,17Z)) C63H104O6 XPPOOLOXNKODLX-CRPDYVFHSA-N -HMDB0051189 954.767641004 TG(20:3(5Z,8Z,11Z)/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 UNYSRSKHDZXMCA-ROKUWRIPSA-N -HMDB0051191 980.783291069 TG(20:3(5Z,8Z,11Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 BAVCCPMFLDZBDC-ZRTIMQPASA-N -HMDB0051193 956.78329106 TG(20:3(5Z,8Z,11Z)/20:3n6/20:3(5Z,8Z,11Z)) C63H104O6 NTEFIKMFLCQZKQ-UYQFGAEOSA-N -HMDB0051198 958.798941133 TG(20:3(5Z,8Z,11Z)/20:3n6/20:2n6) C63H106O6 JHWBUXSCSIHAAE-DXVQZZMDSA-N -HMDB0051199 956.783291069 TG(20:3(5Z,8Z,11Z)/20:3n6/20:3n6) C63H104O6 XJKUBRHQRPUPNX-CSVKIEHWSA-N -HMDB0051200 954.767641004 TG(20:3(5Z,8Z,11Z)/20:3n6/20:4(5Z,8Z,11Z,14Z)) C63H102O6 ORFNHODRKLEDIY-NBEMNRAFSA-N -HMDB0051203 980.783291069 TG(20:3(5Z,8Z,11Z)/20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 BWOCMKYCXIXQRR-OJZPLIJPSA-N -HMDB0051206 954.767641004 TG(20:3(5Z,8Z,11Z)/20:3n6/20:4(8Z,11Z,14Z,17Z)) C63H102O6 IGBVZUBJFIUKFA-RAIBINDCSA-N -HMDB0051207 952.75199094 TG(20:3(5Z,8Z,11Z)/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 CBLVLYIBWALOEM-DCLXTXTESA-N -HMDB0051208 980.783291069 TG(20:3(5Z,8Z,11Z)/20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 FCVBQNIGVMCKAH-LKPKZLGUSA-N -HMDB0051209 978.767641004 TG(20:3(5Z,8Z,11Z)/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 UITJRAHHHRPZTP-KRQZJFPASA-N -HMDB0051211 954.767640996 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)) C63H102O6 DZCKFRKMUJZBAT-LGDXDNCGSA-N -HMDB0051216 956.783291069 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/20:2n6) C63H104O6 HBMNWHFLFHOFFZ-TYZDMGBMSA-N -HMDB0051217 954.767641004 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/20:3n6) C63H102O6 DLVBEOBLMNLHJH-KBVPYHOBSA-N -HMDB0051218 952.75199094 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 MXSSKIVWHBHDLS-WLDSEDHASA-N -HMDB0051220 980.783291069 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 QVOYWQYGRGLLAY-REOKHHNISA-N -HMDB0051221 978.767641004 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 JEYAIOVCJUFECT-VRVABZEDSA-N -HMDB0051223 924.720690811 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 ILYJVOJSUJTWSZ-NPUSVTHISA-N -HMDB0051224 952.75199094 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 PTQQCZRZVMTOPI-XZWLWHDJSA-N -HMDB0051226 978.767641004 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 KSQBRKREYMTJTD-OTLZCYCTSA-N -HMDB0051227 976.75199094 TG(20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 GVAIQYMZMOVIIO-QUZFHRACSA-N -HMDB0051233 958.798941133 TG(20:3(5Z,8Z,11Z)/22:2(13Z,16Z)/18:3(6Z,9Z,12Z)) C63H106O6 GAOSCGSBKHEEEX-ABJDQFALSA-N -HMDB0051240 958.798941133 TG(20:3(5Z,8Z,11Z)/22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C63H106O6 KIWZLPDMTTVSIN-TTZZXANXSA-N -HMDB0051241 956.783291069 TG(20:3(5Z,8Z,11Z)/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 QARMSZHUPFDIOQ-YZFJRGECSA-N -HMDB0051246 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MKUDSHOEWNCTAU-WWTGNTJDSA-N -HMDB0051387 974.736340876 TG(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H98O6 HACBAOINPHYNST-CQLYRNBESA-N -HMDB0051390 942.804026513 TG(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H106O5 OTLKOLCCRBJOBU-GWOODHQGSA-N -HMDB0051392 952.882276835 TG(20:3(5Z,8Z,11Z)/o-18:0/22:1(13Z)) C63H116O5 NTBWBNOELFPOOM-IUSIPSNBSA-N -HMDB0051399 950.866626771 TG(20:3(5Z,8Z,11Z)/o-18:0/22:2(13Z,16Z)) C63H114O5 DBABQSZDEPAQMJ-JRLSHUFTSA-N -HMDB0051401 944.819676578 TG(20:3(5Z,8Z,11Z)/o-18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H108O5 AXXALZKBFIPMAS-WNVUMEOFSA-N -HMDB0051406 944.819676578 TG(20:3(5Z,8Z,11Z)/o-18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H108O5 YXNSTAIJZPYOPN-IUNYBWOESA-N -HMDB0051407 942.804026513 TG(20:3(5Z,8Z,11Z)/o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O5 NNNMVNSALGUZNQ-IIUSWYLASA-N -HMDB0051408 942.86154138 TG(22:1(13Z)/14:0/22:1(13Z)) C61H114O6 KVGQCWIIYQFVAZ-DSOYXUETSA-N -HMDB0051409 970.89284152 TG(22:1(13Z)/14:0/24:1(15Z)) C63H118O6 YSHCWMWSRVVMKQ-RFEPONRGSA-N -HMDB0051410 884.783291069 TG(22:1(13Z)/14:0/18:2(9Z,12Z)) C57H104O6 GFXBBKRPUJCXGD-UPNUHEAOSA-N -HMDB0051411 882.767641004 TG(22:1(13Z)/14:0/18:3(6Z,9Z,12Z)) C57H102O6 CTGSVLMVNLDPLN-ZIPSRPDOSA-N -HMDB0051415 940.845891326 TG(22:1(13Z)/14:0/22:2(13Z,16Z)) C61H112O6 KDKFUFGVHHXTMC-IOQYWATLSA-N -HMDB0051418 882.767641004 TG(22:1(13Z)/14:0/18:3(9Z,12Z,15Z)) C57H102O6 KTVCIQXPZYXPQV-SFRWRGALSA-N -HMDB0051419 880.75199094 TG(22:1(13Z)/14:0/18:4(6Z,9Z,12Z,15Z)) C57H100O6 DOZPBKCIXFDCBR-WXYXMFETSA-N -HMDB0051424 874.835326642 TG(22:1(13Z)/14:0/o-18:0) C57H110O5 NUXBWTCPUJBEJP-NQFDQYIDSA-N -HMDB0051427 898.798941133 TG(22:1(13Z)/15:0/18:2(9Z,12Z)) C58H106O6 ZMLPYXDICDGROD-BQIKIWBJSA-N -HMDB0051428 896.783291069 TG(22:1(13Z)/15:0/18:3(6Z,9Z,12Z)) C58H104O6 QHWWDKOXAJWHAQ-YRYPUPAGSA-N -HMDB0051435 896.783291069 TG(22:1(13Z)/15:0/18:3(9Z,12Z,15Z)) C58H104O6 XPUHNGSIUVKMSD-ORBLRMRESA-N -HMDB0051442 970.892841508 TG(22:1(13Z)/16:0/22:1(13Z)) C63H118O6 UBSHSSBEIAVWOU-LBXGSASVSA-N -HMDB0051446 940.845891326 TG(22:1(13Z)/16:0/20:2n6) C61H112O6 BZDZWWVXHKYJJZ-MNQWXSIMSA-N -HMDB0051447 938.830241262 TG(22:1(13Z)/16:0/20:3n6) C61H110O6 CNDQFBSWPRXSTI-IQEMJYAVSA-N -HMDB0051449 968.877191455 TG(22:1(13Z)/16:0/22:2(13Z,16Z)) C63H116O6 FVDYYPMNUFXGPD-SWORMYSDSA-N -HMDB0051450 964.845891326 TG(22:1(13Z)/16:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 YHKXBBUZMDPXSA-GJYKUPRLSA-N -HMDB0051451 962.830241262 TG(22:1(13Z)/16:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 YSPOTOBPQXVIKH-RYVVUGRYSA-N -HMDB0051456 962.830241262 TG(22:1(13Z)/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 FFRUWMSJKGSWRM-PCPUPOLYSA-N -HMDB0051458 902.866626771 TG(22:1(13Z)/16:0/o-18:0) C59H114O5 DXLAMQSKKMZWNP-AZOUTRKJSA-N -HMDB0051461 940.845891326 TG(22:1(13Z)/18:0/18:2(9Z,12Z)) C61H112O6 SCINELBMQVGABE-CGSGPZGSSA-N -HMDB0051462 938.830241262 TG(22:1(13Z)/18:0/18:3(6Z,9Z,12Z)) C61H110O6 VCPLVQPYTVTKNH-UANQULQISA-N -HMDB0051463 968.877191455 TG(22:1(13Z)/18:0/20:2n6) C63H116O6 VVFRIVIQQBOTDF-KKKPCJSSSA-N -HMDB0051464 966.861541391 TG(22:1(13Z)/18:0/20:3n6) C63H114O6 NFQNKTWBGDXABY-UBYMWZGESA-N -HMDB0051465 964.845891326 TG(22:1(13Z)/18:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 OIMOXMXEHNPADS-GAZXSFRPSA-N -HMDB0051469 938.830241262 TG(22:1(13Z)/18:0/18:3(9Z,12Z,15Z)) C61H110O6 PGNCZCAOFLJMMB-PMEQYAFJSA-N -HMDB0051471 964.845891326 TG(22:1(13Z)/18:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 VFWNWLUEZNPXHB-LZHILDLJSA-N -HMDB0051472 962.830241262 TG(22:1(13Z)/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 MODPITGELPIGOT-LLSJPXHWSA-N -HMDB0051478 968.877191455 TG(22:1(13Z)/20:0/18:2(9Z,12Z)) C63H116O6 AVPYORJSIJFEAZ-LIPCYRNNSA-N -HMDB0051479 966.861541391 TG(22:1(13Z)/20:0/18:3(6Z,9Z,12Z)) C63H114O6 DFWJNSRUGPXPNK-SFBWWLFMSA-N -HMDB0051486 966.861541391 TG(22:1(13Z)/20:0/18:3(9Z,12Z,15Z)) C63H114O6 JNDBWTLJGLLSAK-HWMIBPLFSA-N -HMDB0051487 964.845891326 TG(22:1(13Z)/20:0/18:4(6Z,9Z,12Z,15Z)) C63H112O6 HSOJKQPYAKFWOR-LRVAFUCOSA-N -HMDB0051492 958.929227028 TG(22:1(13Z)/20:0/o-18:0) C63H122O5 DUEKVDIAQKILOH-NYRYLARASA-N -HMDB0051527 940.845891316 TG(22:1(13Z)/14:1(9Z)/22:1(13Z)) C61H112O6 STYLBDUVJOXRMQ-JEDOZFSMSA-N -HMDB0051528 968.877191455 TG(22:1(13Z)/14:1(9Z)/24:1(15Z)) C63H116O6 KTCYPQYXMMRSJQ-BKDMQJNTSA-N -HMDB0051529 882.767641004 TG(22:1(13Z)/14:1(9Z)/18:2(9Z,12Z)) C57H102O6 AMRBACSYMREFMZ-JRGBJOFLSA-N -HMDB0051530 880.75199094 TG(22:1(13Z)/14:1(9Z)/18:3(6Z,9Z,12Z)) C57H100O6 PPUMCDNARAYNQV-QICALWOQSA-N -HMDB0051534 938.830241262 TG(22:1(13Z)/14:1(9Z)/22:2(13Z,16Z)) C61H110O6 LOKPBYPRLSRHNU-ZZKVCCDWSA-N -HMDB0051537 880.75199094 TG(22:1(13Z)/14:1(9Z)/18:3(9Z,12Z,15Z)) C57H100O6 AXCNRVAYUVDITR-AUCRTYPQSA-N -HMDB0051544 968.877191444 TG(22:1(13Z)/16:1(9Z)/22:1(13Z)) C63H116O6 WCCRVFFTKSGKIN-CABVQDRLSA-N -HMDB0051548 938.830241262 TG(22:1(13Z)/16:1(9Z)/20:2n6) C61H110O6 ZQAVPFDERBCAHC-DEDAJHKLSA-N -HMDB0051551 966.861541391 TG(22:1(13Z)/16:1(9Z)/22:2(13Z,16Z)) C63H114O6 KGIVQHRXQYBBBF-DQNLWXPUSA-N -HMDB0051552 962.830241262 TG(22:1(13Z)/16:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 ZNAJMOCCTZFALW-WQUMFGDKSA-N -HMDB0051559 958.798941133 TG(22:1(13Z)/16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 CEJOBDUANZCCOB-IHIVVMQCSA-N -HMDB0051560 900.850976706 TG(22:1(13Z)/16:1(9Z)/o-18:0) C59H112O5 LQPSWGXHWSIHNS-WOQPDSBWSA-N -HMDB0051563 938.830241262 TG(22:1(13Z)/18:1(11Z)/18:2(9Z,12Z)) C61H110O6 MTZJVBULFGKJAO-YZDRKDPZSA-N -HMDB0051565 966.861541391 TG(22:1(13Z)/18:1(11Z)/20:2n6) C63H114O6 IHZYTFVUDKSYSQ-FJJSSVLFSA-N -HMDB0051566 964.845891326 TG(22:1(13Z)/18:1(11Z)/20:3n6) C63H112O6 ZLWQYLIHICZAQN-KWWLSZTKSA-N -HMDB0051567 962.830241262 TG(22:1(13Z)/18:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 SEYKPSIUYHSDMB-DLSZPKIBSA-N -HMDB0051573 962.830241262 TG(22:1(13Z)/18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 BICJWANPZUYADQ-GOPIJOIKSA-N -HMDB0051577 928.882276835 TG(22:1(13Z)/18:1(11Z)/o-18:0) C61H116O5 OKBVCTPHTHIETD-QNSGHZAOSA-N -HMDB0051580 938.830241262 TG(22:1(13Z)/18:1(9Z)/18:2(9Z,12Z)) C61H110O6 JINIMSFSEKJDPB-QKDFGVCKSA-N -HMDB0051582 966.861541391 TG(22:1(13Z)/18:1(9Z)/20:2n6) C63H114O6 JTHJRVKYZXTUQN-HQAASMSZSA-N -HMDB0051583 964.845891326 TG(22:1(13Z)/18:1(9Z)/20:3n6) C63H112O6 LDQMUQGHUBNDTF-GTUCKFPMSA-N -HMDB0051584 962.830241262 TG(22:1(13Z)/18:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 UFGDTAVYJRCYSY-DHVBBUFVSA-N -HMDB0051590 962.830241262 TG(22:1(13Z)/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 SWRZTLLFJSEQMV-BRDXCCORSA-N -HMDB0051594 928.882276835 TG(22:1(13Z)/18:1(9Z)/o-18:0) C61H116O5 WAOXSFHCGYXKMU-SGRYFNBKSA-N -HMDB0051597 966.861541391 TG(22:1(13Z)/20:1(11Z)/18:2(9Z,12Z)) C63H114O6 PDCZMYYCRMCWTG-HEARNLHVSA-N -HMDB0051598 964.845891326 TG(22:1(13Z)/20:1(11Z)/18:3(6Z,9Z,12Z)) C63H112O6 UHCRYPFJSBIIRR-ZQCAJQTISA-N -HMDB0051605 964.845891326 TG(22:1(13Z)/20:1(11Z)/18:3(9Z,12Z,15Z)) C63H112O6 ANCUFEBJPNGQKK-PJTKLRLGSA-N -HMDB0051606 962.830241262 TG(22:1(13Z)/20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 RMAOBGGCPVHDLB-XRXGBTCISA-N -HMDB0051611 956.913576964 TG(22:1(13Z)/20:1(11Z)/o-18:0) C63H120O5 CTLXHWRJDCSACX-YIBOVCKLSA-N -HMDB0051614 962.830241262 TG(22:1(13Z)/20:3(5Z,8Z,11Z)/18:2(9Z,12Z)) C63H110O6 RHAIVLSTPJTGRI-ZVAVANMKSA-N -HMDB0051623 958.798941133 TG(22:1(13Z)/20:3(5Z,8Z,11Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 PFJYUMJZKKKZDO-ODCYVJEASA-N -HMDB0051628 952.882276835 TG(22:1(13Z)/20:3(5Z,8Z,11Z)/o-18:0) C63H116O5 JMSQUIMJQZICKW-JQYGDSFPSA-N -HMDB0051667 964.845891326 TG(22:1(13Z)/18:2(9Z,12Z)/20:2n6) C63H112O6 SZJQKGFMCYFPGP-XLVSEXCPSA-N -HMDB0051668 962.830241262 TG(22:1(13Z)/18:2(9Z,12Z)/20:3n6) C63H110O6 CUSUSJFFOGKHBB-YDBHCJRHSA-N -HMDB0051676 958.798941133 TG(22:1(13Z)/18:2(9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 QPELGHLJZRAEJZ-GESHDORNSA-N -HMDB0051679 926.866626771 TG(22:1(13Z)/18:2(9Z,12Z)/o-18:0) C61H114O5 VBIJXNNOTQKKMT-KMJYMJAJSA-N -HMDB0051684 962.830241262 TG(22:1(13Z)/18:3(6Z,9Z,12Z)/20:2n6) C63H110O6 PKRMTWZVLNHVCA-ZWMBMBCSSA-N -HMDB0051686 958.798941133 TG(22:1(13Z)/18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 YOKRIONVIOTDSJ-LNNOEQMBSA-N -HMDB0051692 958.798941133 TG(22:1(13Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 LQJPCYRTCWFLFO-KTHCYZSRSA-N -HMDB0051693 956.783291069 TG(22:1(13Z)/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 ITLCIQWCSXSTJO-RGZRHKEBSA-N -HMDB0051696 924.850976706 TG(22:1(13Z)/18:3(6Z,9Z,12Z)/o-18:0) C61H112O5 DKJQAINPSUNNDI-ZHZMXFNBSA-N -HMDB0051699 964.845891326 TG(22:1(13Z)/20:2n6/18:2(9Z,12Z)) C63H112O6 VGUNDIMKOJFCKY-XLVSEXCPSA-N -HMDB0051700 962.830241262 TG(22:1(13Z)/20:2n6/18:3(6Z,9Z,12Z)) C63H110O6 VDRHQUDGPLPDPR-HXPJWBRTSA-N -HMDB0051707 962.830241262 TG(22:1(13Z)/20:2n6/18:3(9Z,12Z,15Z)) C63H110O6 KNVSDJVHRPAOCP-QLVRQTKUSA-N -HMDB0051713 954.8979269 TG(22:1(13Z)/20:2n6/o-18:0) C63H118O5 PFINDNIYLCOJHX-XKFLIONZSA-N -HMDB0051716 962.830241262 TG(22:1(13Z)/20:3n6/18:2(9Z,12Z)) C63H110O6 BQXCEUPRWWRHCG-ZOLJBPJSSA-N -HMDB0051725 958.798941133 TG(22:1(13Z)/20:3n6/18:4(6Z,9Z,12Z,15Z)) C63H106O6 SAWHJLXGHUDEDK-BPOHVAMESA-N -HMDB0051730 952.882276835 TG(22:1(13Z)/20:3n6/o-18:0) C63H116O5 IDBSAKGNYNUSJB-RSZPGGPNSA-N -HMDB0051734 958.798941133 TG(22:1(13Z)/20:4(5Z,8Z,11Z,14Z)/18:3(6Z,9Z,12Z)) C63H106O6 FPHMGBWHJXWNSY-KDCVKOTRSA-N -HMDB0051741 958.798941133 TG(22:1(13Z)/20:4(5Z,8Z,11Z,14Z)/18:3(9Z,12Z,15Z)) C63H106O6 QGLJFPIPRSJLBD-GRHAPZGTSA-N -HMDB0051742 956.783291069 TG(22:1(13Z)/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 WFNPIEVTDGQDNF-BTLOHRQRSA-N -HMDB0051747 950.866626771 TG(22:1(13Z)/20:4(5Z,8Z,11Z,14Z)/o-18:0) C63H114O5 NFYYDFZZKBBWRC-WYOGKZTQSA-N -HMDB0051803 962.830241262 TG(22:1(13Z)/18:3(9Z,12Z,15Z)/20:2n6) C63H110O6 GITBOGBAISSPME-QLVRQTKUSA-N -HMDB0051805 958.798941133 TG(22:1(13Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 ZTJYQIYMUQWSOC-RTHZBEBXSA-N -HMDB0051811 958.798941133 TG(22:1(13Z)/18:3(9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 FSGZYGYLCKMUKP-JOPRWWPBSA-N -HMDB0051812 956.783291069 TG(22:1(13Z)/18:3(9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 NLIRMXKSZFVANY-QOHOVFPRSA-N -HMDB0051815 924.850976706 TG(22:1(13Z)/18:3(9Z,12Z,15Z)/o-18:0) C61H112O5 FTYRINBVXMECCW-NUNGZDAFSA-N -HMDB0051821 958.798941133 TG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/20:3n6) C63H106O6 QCZNYKXKMTUJGT-VTPCHKJASA-N -HMDB0051822 956.783291069 TG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 NWUKMNBNRHWGKD-YUPMGCFISA-N -HMDB0051828 956.783291069 TG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 GAGJGQSTFRQNAT-JHTBMAAWSA-N -HMDB0051829 954.767641004 TG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 DCYWSDMCLMGYLN-VCINXCKRSA-N -HMDB0051831 980.783291069 TG(22:1(13Z)/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 HHDZLCQDAWUVBO-FPPATSECSA-N -HMDB0051836 958.798941133 TG(22:1(13Z)/20:4(8Z,11Z,14Z,17Z)/18:3(6Z,9Z,12Z)) C63H106O6 TWMZUNYBAPKPNZ-TWAKDILZSA-N -HMDB0051843 958.798941133 TG(22:1(13Z)/20:4(8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z)) C63H106O6 IWLAXAPEIGUTCB-OOHWCSMUSA-N -HMDB0051844 956.783291069 TG(22:1(13Z)/20:4(8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 CEDIQWAKNMQFHR-ADTHWEOGSA-N -HMDB0051849 950.866626771 TG(22:1(13Z)/20:4(8Z,11Z,14Z,17Z)/o-18:0) C63H114O5 HUNYHNIYIYCFKC-LPSAMZCDSA-N -HMDB0051852 958.798941133 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:2(9Z,12Z)) C63H106O6 PBKAVJDINREZJK-VKQQFCBNSA-N -HMDB0051853 956.783291069 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(6Z,9Z,12Z)) C63H104O6 ODFCEYTWBQSXQC-GNUIQNHZSA-N -HMDB0051860 956.783291069 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z)) C63H104O6 MNOSBSFAFCETAL-VJXNLZDLSA-N -HMDB0051861 954.767641004 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C63H102O6 NGQPUERHGUGMCW-GHTHOHBRSA-N -HMDB0051863 980.783291069 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H104O6 ZZHQPHMTXYHRIT-OBQUUIHPSA-N -HMDB0051866 948.850976706 TG(22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C63H112O5 DUYBKOXPEWXVRC-VEDBHAGFSA-N -HMDB0051895 980.783291069 TG(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C65H104O6 BXWJNVALZYFZLM-NPRDMZFTSA-N -HMDB0051903 926.866626771 TG(22:1(13Z)/o-18:0/18:2(9Z,12Z)) C61H114O5 SDWPVMNEXQULAT-KMJYMJAJSA-N -HMDB0051904 924.850976706 TG(22:1(13Z)/o-18:0/18:3(6Z,9Z,12Z)) C61H112O5 YBMSPSGALOVJLN-WEGMRAKCSA-N -HMDB0051905 954.8979269 TG(22:1(13Z)/o-18:0/20:2n6) C63H118O5 VRADBIPNMXGYIT-XKFLIONZSA-N -HMDB0051906 952.882276835 TG(22:1(13Z)/o-18:0/20:3n6) C63H116O5 DMGBYZOKWLAVIY-ZHJDXWBJSA-N -HMDB0051907 950.866626771 TG(22:1(13Z)/o-18:0/20:4(5Z,8Z,11Z,14Z)) C63H114O5 BPRIEDPMPZRCDU-TUGJCTNUSA-N -HMDB0051911 924.850976706 TG(22:1(13Z)/o-18:0/18:3(9Z,12Z,15Z)) C61H112O5 RYXWSTIICMYXLZ-NUNGZDAFSA-N -HMDB0051913 950.866626771 TG(22:1(13Z)/o-18:0/20:4(8Z,11Z,14Z,17Z)) C63H114O5 JIJSROMUTDPOMJ-DIIGKJGESA-N -HMDB0051914 948.850976706 TG(22:1(13Z)/o-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H112O5 IEOSRVGEECHXBY-YQRHRKITSA-N -HMDB0051920 940.845891326 TG(24:1(15Z)/14:0/20:2n6) C61H112O6 OFHXYQPJQBMTND-GQHCNAEHSA-N -HMDB0051921 938.830241262 TG(24:1(15Z)/14:0/20:3n6) C61H110O6 XHCVMVYSBUVFNX-SUDOPNQZSA-N -HMDB0051923 968.877191455 TG(24:1(15Z)/14:0/22:2(13Z,16Z)) C63H116O6 ZXIGPBPGGKUILK-RZNDGKSGSA-N -HMDB0051924 964.845891326 TG(24:1(15Z)/14:0/22:4(7Z,10Z,13Z,16Z)) C63H112O6 FRJVUQNOKPPWFF-BVRGJCLJSA-N -HMDB0051925 962.830241262 TG(24:1(15Z)/14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H110O6 DKFCABSRSLZDFF-DPRADSHVSA-N -HMDB0051930 962.830241262 TG(24:1(15Z)/14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H110O6 OCZVBYXRRPOZFY-YQZKCMBXSA-N -HMDB0051932 902.866626771 TG(24:1(15Z)/14:0/o-18:0) C59H114O5 ZUDALJHGXKNMOO-LDEKSDTBSA-N -HMDB0051950 940.845891326 TG(24:1(15Z)/16:0/18:2(9Z,12Z)) C61H112O6 ULURBNZZTGHIHV-PWVLQJRVSA-N -HMDB0051951 938.830241262 TG(24:1(15Z)/16:0/18:3(6Z,9Z,12Z)) C61H110O6 GBQSFVXSYJLCAE-YQDBSOIPSA-N -HMDB0051952 968.877191455 TG(24:1(15Z)/16:0/20:2n6) C63H116O6 QUQYRBGCIMSPCK-XTWJSKLOSA-N -HMDB0051953 966.861541391 TG(24:1(15Z)/16:0/20:3n6) C63H114O6 XZWHNXBAQKSDHH-JZTMEDRYSA-N -HMDB0051954 964.845891326 TG(24:1(15Z)/16:0/20:4(5Z,8Z,11Z,14Z)) C63H112O6 QSWDCFMAGFRFLB-BDZCCHQKSA-N -HMDB0051958 938.830241262 TG(24:1(15Z)/16:0/18:3(9Z,12Z,15Z)) C61H110O6 QCNRTBOAVXTQRH-SNKJKWPVSA-N -HMDB0051960 964.845891326 TG(24:1(15Z)/16:0/20:4(8Z,11Z,14Z,17Z)) C63H112O6 BXVJGJVJSKVGMC-ODQDLHOGSA-N -HMDB0051961 962.830241262 TG(24:1(15Z)/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H110O6 OYZCTROWQJHDDM-ULEWYUDKSA-N -HMDB0051966 968.877191455 TG(24:1(15Z)/18:0/18:2(9Z,12Z)) C63H116O6 UFUYTFWOBBTMIA-JOOBHXTJSA-N -HMDB0051967 966.861541391 TG(24:1(15Z)/18:0/18:3(6Z,9Z,12Z)) C63H114O6 NNBFKLFMPMDQEJ-ZUPCQKIOSA-N -HMDB0051974 966.861541391 TG(24:1(15Z)/18:0/18:3(9Z,12Z,15Z)) C63H114O6 OKMPYBUPDFDIHC-LDOFVRLXSA-N -HMDB0051975 964.845891326 TG(24:1(15Z)/18:0/18:4(6Z,9Z,12Z,15Z)) C63H112O6 MWLKTPCHSMXLLY-KYXQNJKZSA-N -HMDB0051980 958.929227028 TG(24:1(15Z)/18:0/o-18:0) C63H122O5 MJAVAMAWXATTJN-NYRYLARASA-N -HMDB0052032 938.830241262 TG(24:1(15Z)/14:1(9Z)/20:2n6) C61H110O6 PWBWZFOUPAVKBH-NSRVMUEISA-N -HMDB0052035 966.861541391 TG(24:1(15Z)/14:1(9Z)/22:2(13Z,16Z)) C63H114O6 HUFAUCRKBKDFDP-WFSYSZDYSA-N -HMDB0052036 962.830241262 TG(24:1(15Z)/14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H110O6 LIBQPQCZEFGZPS-LTNPSJMOSA-N -HMDB0052043 958.798941133 TG(24:1(15Z)/14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 QIPKPBOQLFJNQW-JYDVVZDMSA-N -HMDB0052044 900.850976706 TG(24:1(15Z)/14:1(9Z)/o-18:0) C59H112O5 XPDLXJYQTJBVLY-LRLRNOKKSA-N -HMDB0052046 938.830241262 TG(24:1(15Z)/16:1(9Z)/18:2(9Z,12Z)) C61H110O6 DWQHZFVQEBNFQY-XRXULKSWSA-N -HMDB0052048 966.861541391 TG(24:1(15Z)/16:1(9Z)/20:2n6) C63H114O6 SBNMRUIGCHPGON-RKIBRSHDSA-N -HMDB0052049 964.845891326 TG(24:1(15Z)/16:1(9Z)/20:3n6) C63H112O6 ZAMSJHWTYQXQPY-JZDSNLEASA-N -HMDB0052050 962.830241262 TG(24:1(15Z)/16:1(9Z)/20:4(5Z,8Z,11Z,14Z)) C63H110O6 PQVAMULAOIDXID-FNEXOFSJSA-N -HMDB0052056 962.830241262 TG(24:1(15Z)/16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C63H110O6 PJDOXWVMHBYGBX-VBYALZHZSA-N -HMDB0052060 928.882276835 TG(24:1(15Z)/16:1(9Z)/o-18:0) C61H116O5 JQKSTWZRLSFFJF-JLSFSZCSSA-N -HMDB0052062 966.861541391 TG(24:1(15Z)/18:1(11Z)/18:2(9Z,12Z)) C63H114O6 OQDCWOUJNQSYMR-DPJMPHFLSA-N -HMDB0052063 964.845891326 TG(24:1(15Z)/18:1(11Z)/18:3(6Z,9Z,12Z)) C63H112O6 FQOOBZWSSFBGRJ-PUXYSJNBSA-N -HMDB0052070 964.845891326 TG(24:1(15Z)/18:1(11Z)/18:3(9Z,12Z,15Z)) C63H112O6 RUSCMJMSQIOWQE-JVPAGSFPSA-N -HMDB0052071 962.830241262 TG(24:1(15Z)/18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 WPTDLSWTVUJAOX-YHDAGPPLSA-N -HMDB0052076 956.913576964 TG(24:1(15Z)/18:1(11Z)/o-18:0) C63H120O5 MVFBCZDAWPPNMN-CNKHIDIQSA-N -HMDB0052078 966.861541391 TG(24:1(15Z)/18:1(9Z)/18:2(9Z,12Z)) C63H114O6 NFYLWGALGFJXKV-VUCGYDTISA-N -HMDB0052079 964.845891326 TG(24:1(15Z)/18:1(9Z)/18:3(6Z,9Z,12Z)) C63H112O6 WKTQVQIRLRPGDR-AIYLCWKHSA-N -HMDB0052086 964.845891326 TG(24:1(15Z)/18:1(9Z)/18:3(9Z,12Z,15Z)) C63H112O6 CGQLVCFUDCESMV-ONVKFWOQSA-N -HMDB0052087 962.830241262 TG(24:1(15Z)/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C63H110O6 XPNUDVKOGAAXPS-IASDWQFSSA-N -HMDB0052092 956.913576964 TG(24:1(15Z)/18:1(9Z)/o-18:0) C63H120O5 RVMQNMKFUZZTPY-FFSMKODBSA-N -HMDB0052158 964.845891326 TG(24:1(15Z)/18:2(9Z,12Z)/18:2(9Z,12Z)) C63H112O6 LEISCWOXEYMOAG-YAZYAHKFSA-N -HMDB0052159 962.830241262 TG(24:1(15Z)/18:2(9Z,12Z)/18:3(6Z,9Z,12Z)) C63H110O6 DVVXILVDNWEYLR-ORGOULGJSA-N -HMDB0052166 962.830241262 TG(24:1(15Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) C63H110O6 HMLHWNHLFKBMRY-ZGCCQQRHSA-N -HMDB0052172 954.8979269 TG(24:1(15Z)/18:2(9Z,12Z)/o-18:0) C63H118O5 GCHDZYLUKSEHHL-NEPMHRMMSA-N -HMDB0052174 962.830241262 TG(24:1(15Z)/18:3(6Z,9Z,12Z)/18:2(9Z,12Z)) C63H110O6 APLABQCESRGFRN-LQUJYBKRSA-N -HMDB0052183 958.798941133 TG(24:1(15Z)/18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 WVWWFHQLYDZJNM-VGIPEQTASA-N -HMDB0052188 952.882276835 TG(24:1(15Z)/18:3(6Z,9Z,12Z)/o-18:0) C63H116O5 FIXNXVIJNBXNSK-BXCHJCNZSA-N -HMDB0052286 962.830241262 TG(24:1(15Z)/18:3(9Z,12Z,15Z)/18:2(9Z,12Z)) C63H110O6 NAYLGIBYZIJGJI-DBZHIINUSA-N -HMDB0052295 958.798941133 TG(24:1(15Z)/18:3(9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 XMEDZNCDBPSROA-MJBKJXDCSA-N -HMDB0052300 952.882276835 TG(24:1(15Z)/18:3(9Z,12Z,15Z)/o-18:0) C63H116O5 UQQUTEPSRVSYRH-BVNIRHBSSA-N -HMDB0052303 958.798941133 TG(24:1(15Z)/18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)) C63H106O6 SBHVXVGIUJBNSJ-CCERIMPBSA-N -HMDB0052310 958.798941133 TG(24:1(15Z)/18:4(6Z,9Z,12Z,15Z)/18:3(9Z,12Z,15Z)) C63H106O6 DIQHRWHXSVXJHW-QJWAGHRUSA-N -HMDB0052311 956.783291069 TG(24:1(15Z)/18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 HGDIZRAUCJKNGD-LGQABYQNSA-N -HMDB0052316 950.866626771 TG(24:1(15Z)/18:4(6Z,9Z,12Z,15Z)/o-18:0) C63H114O5 STBHWPRLUZOAIJ-ZWQRGCETSA-N -HMDB0052382 954.8979269 TG(24:1(15Z)/o-18:0/18:2(9Z,12Z)) C63H118O5 FMMAGCQSTTUUOF-NEPMHRMMSA-N -HMDB0052383 952.882276835 TG(24:1(15Z)/o-18:0/18:3(6Z,9Z,12Z)) C63H116O5 TVASWGWPZXLFFR-LBUQORGQSA-N -HMDB0052390 952.882276835 TG(24:1(15Z)/o-18:0/18:3(9Z,12Z,15Z)) C63H116O5 MGIADBDESXZBTF-BVNIRHBSSA-N -HMDB0052391 950.866626771 TG(24:1(15Z)/o-18:0/18:4(6Z,9Z,12Z,15Z)) C63H114O5 HMRLAHOLCLZNNW-OIVAJGPLSA-N -HMDB0052399 852.720690811 TG(18:2(9Z,12Z)/14:0/20:3n6) C55H96O6 LPABDPJNNDGDTQ-BLIQHNSJSA-N -HMDB0052401 882.767641004 TG(18:2(9Z,12Z)/14:0/22:2(13Z,16Z)) C57H102O6 LDVDALBKRWDBPL-WTNQUSKBSA-N -HMDB0052416 896.783291069 TG(18:2(9Z,12Z)/15:0/22:2(13Z,16Z)) C58H104O6 YJZARZPHBIAWSP-WFWVJCKJSA-N -HMDB0052427 852.720690811 TG(18:2(9Z,12Z)/16:0/18:3(6Z,9Z,12Z)) C55H96O6 GIPISOXQGTUPKE-ZWNRZCITSA-N -HMDB0052428 882.767641004 TG(18:2(9Z,12Z)/16:0/20:2n6) C57H102O6 HYPYKVIIWHXPAS-BIBJHKLQSA-N -HMDB0052429 880.75199094 TG(18:2(9Z,12Z)/16:0/20:3n6) C57H100O6 FPBJHRGEWAYSDO-NWQIFYSBSA-N -HMDB0052441 882.767641004 TG(18:2(9Z,12Z)/18:0/18:2(9Z,12Z)) C57H102O6 FGNXNKQAEKNDNA-XEUHHCTMSA-N -HMDB0052442 880.75199094 TG(18:2(9Z,12Z)/18:0/18:3(6Z,9Z,12Z)) C57H100O6 RRQQICLGULVDHJ-TUEOCVOPSA-N -HMDB0052446 938.830241262 TG(18:2(9Z,12Z)/18:0/22:2(13Z,16Z)) C61H110O6 RLGAQDGPQYEBLL-XHVXYWQYSA-N -HMDB0052458 938.830241262 TG(18:2(9Z,12Z)/20:0/20:2n6) C61H110O6 CYKZBIMIYCZCIP-MRTMRHDRSA-N -HMDB0052461 966.861541391 TG(18:2(9Z,12Z)/20:0/22:2(13Z,16Z)) C63H114O6 WUPOLOVISVVRIA-JBYCBOJFSA-N -HMDB0052462 962.830241262 TG(18:2(9Z,12Z)/20:0/22:4(7Z,10Z,13Z,16Z)) C63H110O6 HKRSQYQLQNSHTO-XBEKDICWSA-N -HMDB0052469 958.798941133 TG(18:2(9Z,12Z)/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O6 SRVIIJLKVZLBAK-OAQBWKPISA-N -HMDB0052470 900.850976706 TG(18:2(9Z,12Z)/20:0/o-18:0) C59H112O5 XYFSTETYCVWOEN-KLWJSLDDSA-N -HMDB0052471 938.830241262 TG(18:2(9Z,12Z)/22:0/18:2(9Z,12Z)) C61H110O6 CVWPTSPATKBGFJ-FCWOHNRGSA-N -HMDB0052473 966.861541391 TG(18:2(9Z,12Z)/22:0/20:2n6) C63H114O6 ADPNGIWOVLEKOB-PCWKMLBBSA-N -HMDB0052474 964.845891326 TG(18:2(9Z,12Z)/22:0/20:3n6) C63H112O6 INDPJVIDKWBQSJ-BCVUUJCASA-N -HMDB0052475 962.830241262 TG(18:2(9Z,12Z)/22:0/20:4(5Z,8Z,11Z,14Z)) C63H110O6 CBQQNGMIEQUSNE-CBOGNYGUSA-N -HMDB0052481 962.830241262 TG(18:2(9Z,12Z)/22:0/20:4(8Z,11Z,14Z,17Z)) C63H110O6 UOQDSEPRWVVBKV-FWKCDYCVSA-N -HMDB0052485 928.882276835 TG(18:2(9Z,12Z)/22:0/o-18:0) C61H116O5 PZMSAQJXASOAPE-FMZYJFPSSA-N -HMDB0052486 966.861541391 TG(18:2(9Z,12Z)/24:0/18:2(9Z,12Z)) C63H114O6 WDLBTJHWGYBSCW-ZQQHQYNCSA-N -HMDB0052487 964.845891326 TG(18:2(9Z,12Z)/24:0/18:3(6Z,9Z,12Z)) C63H112O6 DYXIHLFAMCSWDP-KSAGRNAESA-N -HMDB0052494 964.845891326 TG(18:2(9Z,12Z)/24:0/18:3(9Z,12Z,15Z)) C63H112O6 PULVRMWMRNJUAS-SOTXLCDASA-N -HMDB0052495 962.830241262 TG(18:2(9Z,12Z)/24:0/18:4(6Z,9Z,12Z,15Z)) C63H110O6 IMMYAYNDFJZVBZ-FKZIQONFSA-N -HMDB0052500 956.913576964 TG(18:2(9Z,12Z)/24:0/o-18:0) C63H120O5 HQJZLKIOUYEPDB-RVEZQVEJSA-N -HMDB0052503 852.720690811 TG(18:2(9Z,12Z)/14:1(9Z)/20:2n6) C55H96O6 JKLVWHFEADJCSE-OKEXGHLUSA-N -HMDB0052506 880.75199094 TG(18:2(9Z,12Z)/14:1(9Z)/22:2(13Z,16Z)) C57H100O6 SFCNWLSIOSCRMM-DBWLQLOESA-N -HMDB0052516 852.720690811 TG(18:2(9Z,12Z)/16:1(9Z)/18:2(9Z,12Z)) C55H96O6 SFSFPCWGADNGHN-BDMHOKOOSA-N -HMDB0052518 880.75199094 TG(18:2(9Z,12Z)/16:1(9Z)/20:2n6) C57H100O6 GBKMWLHIRAKLID-VHWXVXHCSA-N -HMDB0052529 900.720690811 TG(18:2(9Z,12Z)/16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 MKTVKWIGWXIEHG-YJGXQOQOSA-N 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TG(18:2(9Z,12Z)/20:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 FZVSVPNSNPCVJK-SVPKEUKBSA-N -HMDB0052573 958.798941133 TG(18:2(9Z,12Z)/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 TZEDWJDIOLCDJN-RBJHLLPSSA-N -HMDB0052574 956.783291069 TG(18:2(9Z,12Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 AHTTULMKWLTZHP-BMDPEGLOSA-N -HMDB0052582 956.783291069 TG(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 GATBTSFSXXAQAW-OEUXJVTFSA-N -HMDB0052583 954.767641004 TG(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 UGHFVGFGLYJRIY-HUOAFJCPSA-N -HMDB0052585 900.720690811 TG(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 DQYDIASSVQDEIU-BRGPTBNDSA-N -HMDB0052588 954.767641004 TG(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 HNDHOYSSWMWISN-HWBKHRQFSA-N -HMDB0052589 952.75199094 TG(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 RFXAXHWRVMQUCI-CLXZRIJWSA-N -HMDB0052593 964.845891326 TG(18:2(9Z,12Z)/22:1(13Z)/20:2n6) C63H112O6 ASHDSIZMSUYRGL-VVAYQMRPSA-N -HMDB0052594 962.830241262 TG(18:2(9Z,12Z)/22:1(13Z)/20:3n6) C63H110O6 JWUGOBDQRTWQDM-LOFJDGKISA-N -HMDB0052602 958.798941133 TG(18:2(9Z,12Z)/22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 QNNMKCWGRUYNED-MSOVQMLESA-N -HMDB0052605 926.866626771 TG(18:2(9Z,12Z)/22:1(13Z)/o-18:0) C61H114O5 IRNARDRWANMWOS-KMJYMJAJSA-N -HMDB0052606 964.845891326 TG(18:2(9Z,12Z)/24:1(15Z)/18:2(9Z,12Z)) C63H112O6 POKWAFRJAZNFSU-NWOKJHHTSA-N -HMDB0052607 962.830241262 TG(18:2(9Z,12Z)/24:1(15Z)/18:3(6Z,9Z,12Z)) C63H110O6 GUXKXSATTNLTNC-ORGOULGJSA-N -HMDB0052614 962.830241262 TG(18:2(9Z,12Z)/24:1(15Z)/18:3(9Z,12Z,15Z)) C63H110O6 YLZNOVLTDCHRND-ZGCCQQRHSA-N -HMDB0052620 954.8979269 TG(18:2(9Z,12Z)/24:1(15Z)/o-18:0) C63H118O5 JECSEZDUELWFJD-NEPMHRMMSA-N -HMDB0052635 868.788376449 TG(18:2(9Z,12Z)/18:2(9Z,12Z)/o-18:0) C57H104O5 MUYSBOYFSLCKQE-NYFSQYCDSA-N -HMDB0052640 900.720690811 TG(18:2(9Z,12Z)/18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,14Z)) C59H96O6 HNCZROXFYKAXOH-YSGVHZNESA-N 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TG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/18:3(9Z,12Z,15Z)) C59H96O6 LDKWKDUYZWZDBQ-JCVCCHMVSA-N -HMDB0052691 926.736340876 TG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C61H98O6 MHQQXKMTIMDITH-BRJPCWTOSA-N -HMDB0052692 924.720690811 TG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 VZMDAERKCFBEMZ-ILVFMXOCSA-N -HMDB0052693 952.75199094 TG(18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 CJMQGODMMNFMOQ-ORXARHRGSA-N -HMDB0052698 962.830241262 TG(18:2(9Z,12Z)/22:2(13Z,16Z)/20:2n6) C63H110O6 ZNOAWGZVSGWABO-UDMNNMADSA-N -HMDB0052700 958.798941133 TG(18:2(9Z,12Z)/22:2(13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 GQFRMDOUNSKSDC-IULOVJQKSA-N -HMDB0052706 958.798941133 TG(18:2(9Z,12Z)/22:2(13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 JBDJDXZTHMTVDR-ZTFOUFTDSA-N -HMDB0052707 956.783291069 TG(18:2(9Z,12Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 CDFSSVIAZNGTBZ-WJCALSCWSA-N -HMDB0052710 924.850976706 TG(18:2(9Z,12Z)/22:2(13Z,16Z)/o-18:0) C61H112O5 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TG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 PLAOSKWDTZUAOS-SFXPLPMRSA-N -HMDB0053147 924.720690811 TG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 ICVAHKOZRSLUFQ-KINDLXIOSA-N -HMDB0053148 952.75199094 TG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 RRXSURPJVARICW-KLOKDZRKSA-N -HMDB0053150 978.767641004 TG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 GLNXLYRBLGFBLW-HYAWBGIDSA-N -HMDB0053151 976.75199094 TG(18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 JYUPBLUIDGVNML-LEANLVNISA-N -HMDB0053153 924.720690804 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)) C61H96O6 QADBLNHWOKOYDH-DUAURTHGSA-N -HMDB0053154 954.767641004 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:2n6) C63H102O6 HWIXODUOTVEHET-CNAMJHDQSA-N -HMDB0053155 952.75199094 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:3n6) C63H100O6 WLKYPPYVGVLSFZ-DZEINTEQSA-N -HMDB0053158 978.767641004 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)) C65H102O6 DOCRXAVOQFBILA-LTOUURHRSA-N -HMDB0053159 976.75199094 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H100O6 SSHNUYNODGSBKZ-CPELRYCASA-N -HMDB0053160 924.720690811 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C61H96O6 SETAFKXUOLRYMX-ZWIGYPITSA-N -HMDB0053164 976.75199094 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 LZINVXSWUNMSJK-WMBLJDNQSA-N -HMDB0053165 974.736340876 TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 ZINMHJGMXNZUON-ASXZPPHZSA-N -HMDB0053169 900.720690811 TG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/20:3n6) C59H96O6 GHZUZGDZYLIXSI-ZLTIJRARSA-N -HMDB0053173 924.720690811 TG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C61H96O6 MJTWPTSBGBSEIL-AQZTZEFFSA-N -HMDB0053178 924.720690811 TG(18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 GBTJDANNDZMCSO-TVEHCWGWSA-N -HMDB0053182 900.720690811 TG(18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/20:2n6) C59H96O6 USAUVXGGZAHQNY-KQCHPSEHSA-N -HMDB0053186 924.720690811 TG(18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C61H96O6 KTBQPCJSPGEYHH-IYYZHSNDSA-N -HMDB0053198 924.720690811 TG(18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C61H96O6 LEMUUXQSONCZBR-GKPKBBGDSA-N -HMDB0053199 956.783291069 TG(18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) C63H104O6 IWQXPFWRVPSQSD-GUWIYQCRSA-N -HMDB0053200 952.75199094 TG(18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C63H100O6 VMOOWSPQGJCOEF-ZVTUCBFNSA-N -HMDB0053204 924.720690811 TG(18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C61H96O6 AODBNMOGHKMQLM-QEBGWZISSA-N -HMDB0053211 924.720690811 TG(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6) C61H96O6 VQSBVFWLIMSUKU-JLYXARIGSA-N -HMDB0053213 954.767641004 TG(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) C63H102O6 FIVPYAHJKISIKY-NBMRXVETSA-N -HMDB0053223 924.720690804 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962.830241262 TG(20:2n6/20:0/20:4(8Z,11Z,14Z,17Z)) C63H110O6 AAARRLVSWMMLIL-JFDCHTIYSA-N -HMDB0053328 928.882276835 TG(20:2n6/20:0/o-18:0) C61H116O5 REPZHTARFKJLGK-UWVPRLFQSA-N -HMDB0053335 964.845891326 TG(20:2n6/22:0/18:3(9Z,12Z,15Z)) C63H112O6 JQHWRRJYPOHAKD-QZHYZABFSA-N -HMDB0053336 962.830241262 TG(20:2n6/22:0/18:4(6Z,9Z,12Z,15Z)) C63H110O6 XOYMYYRTVUGSGP-GRCDQXJASA-N -HMDB0053341 956.913576964 TG(20:2n6/22:0/o-18:0) C63H120O5 DZWPMQPSPOGAGG-YAGAPKITSA-N -HMDB0053355 880.75199094 TG(20:2n6/14:1(9Z)/20:2n6) C57H100O6 JOUMXYIISHXANV-RWBIAYFFSA-N -HMDB0053366 900.720690811 TG(20:2n6/14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 QZUZXWSQFLLIBE-XWMCOJDTSA-N -HMDB0053367 842.772726384 TG(20:2n6/14:1(9Z)/o-18:0) C55H102O5 RJJPSRSFWRKXGV-GTWSWVPXSA-N -HMDB0053380 870.804026513 TG(20:2n6/16:1(9Z)/o-18:0) C57H106O5 IYSQDSJAZVXCDU-HPLDLCQESA-N -HMDB0053384 964.845891326 TG(20:2n6/18:1(11Z)/22:2(13Z,16Z)) C63H112O6 NOLCSFQLXSPJBG-DOYZNESKSA-N -HMDB0053386 958.798941133 TG(20:2n6/18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 ULRJOCSDJZFMFY-ZJWVVZHGSA-N -HMDB0053391 958.798941133 TG(20:2n6/18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 RWRADNFFPOHHEA-UNEUZNPLSA-N -HMDB0053392 956.783291069 TG(20:2n6/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 YOEYZADNHRXJJT-WBBOMUOZSA-N -HMDB0053397 964.845891326 TG(20:2n6/18:1(9Z)/22:2(13Z,16Z)) C63H112O6 PRNZTHLFVCDZAV-SFKXYMDKSA-N -HMDB0053399 958.798941133 TG(20:2n6/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 LZZJAKQUDMTSMD-VRHRGAFOSA-N -HMDB0053404 958.798941133 TG(20:2n6/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 QKUJSLKNYNFMCG-WAOWULNYSA-N -HMDB0053405 956.783291069 TG(20:2n6/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 GAWBNAJJRJBPMU-WSUSZCAPSA-N -HMDB0053407 964.845891326 TG(20:2n6/20:1(11Z)/20:2n6) C63H112O6 VLYQASCCDNGEQJ-GGDOOUPISA-N -HMDB0053408 962.830241262 TG(20:2n6/20:1(11Z)/20:3n6) C63H110O6 BODCPTKZTGBALI-NBJGVIAESA-N -HMDB0053416 958.798941133 TG(20:2n6/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 QJLUNEFXQRDKLC-MQNBCSLYSA-N -HMDB0053419 926.866626771 TG(20:2n6/20:1(11Z)/o-18:0) C61H114O5 INURSZUTYWHVKL-IUJIAQQVSA-N -HMDB0053421 958.798941133 TG(20:2n6/20:3(5Z,8Z,11Z)/20:3n6) C63H106O6 LFYKWGODUKKZEK-PQJBSVHZSA-N -HMDB0053422 956.783291069 TG(20:2n6/20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 SATBWAXPKBXLEF-NMJZXWEMSA-N -HMDB0053428 956.783291069 TG(20:2n6/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 SXLSGVHVTGSALG-IDWIRJJXSA-N -HMDB0053429 954.767641004 TG(20:2n6/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 PNNSMRQLANHRDX-XBLZGWIDSA-N -HMDB0053431 980.783291069 TG(20:2n6/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 LGZBYVCHRDGVGD-PDDMCSIKSA-N -HMDB0053439 962.830241262 TG(20:2n6/22:1(13Z)/18:3(9Z,12Z,15Z)) C63H110O6 XTPPLMSBGCFPTO-QLVRQTKUSA-N -HMDB0053445 954.8979269 TG(20:2n6/22:1(13Z)/o-18:0) C63H118O5 UWHCZBAFYYHHRB-XKFLIONZSA-N -HMDB0053462 962.830241262 TG(20:2n6/18:2(9Z,12Z)/22:2(13Z,16Z)) C63H110O6 HWOAMJMEVLUICF-UDMNNMADSA-N -HMDB0053463 958.798941133 TG(20:2n6/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 BLUODYRHIPCAQS-OACMGENOSA-N -HMDB0053464 956.783291069 TG(20:2n6/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 COZVSHKROVOQOP-STEKBIBLSA-N -HMDB0053469 956.783291069 TG(20:2n6/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 QTYYFJGKWKUBSQ-AHGFPKGFSA-N -HMDB0053470 954.767641004 TG(20:2n6/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 IIZFWHKVNJTNPQ-CQALYHPNSA-N -HMDB0053476 956.783291069 TG(20:2n6/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 MGEAOKJODZKTKX-ISICLPBDSA-N -HMDB0053477 954.767641004 TG(20:2n6/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 BSLYTXPSABCJNS-DBCIVTTOSA-N -HMDB0053479 900.720690811 TG(20:2n6/18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 PARVDVGUFPHHJQ-OHLXLZLUSA-N -HMDB0053482 954.767641004 TG(20:2n6/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 YKRAKIKUUNSETH-JOLCNQCDSA-N -HMDB0053483 952.75199094 TG(20:2n6/18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 LLRMOUDUDWTCRD-YDLPISMNSA-N -HMDB0053485 962.830241262 TG(20:2n6/20:2n6/20:2n6) C63H110O6 LYUOZIPQCKXNPX-BBWANDEASA-N -HMDB0053487 958.798941133 TG(20:2n6/20:2n6/20:4(5Z,8Z,11Z,14Z)) C63H106O6 VIIWKEJLCOZGMH-FHOJAIQOSA-N -HMDB0053493 958.798941133 TG(20:2n6/20:2n6/20:4(8Z,11Z,14Z,17Z)) C63H106O6 NJJRJRJTWCCNNE-XITMTEFESA-N -HMDB0053494 956.783291069 TG(20:2n6/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 VLMFXQRKOXVLPZ-PXQUNIJTSA-N -HMDB0053497 924.850976706 TG(20:2n6/20:2n6/o-18:0) C61H112O5 PFTGNQCYADESFM-FVCLJNECSA-N -HMDB0053499 958.798941133 TG(20:2n6/20:3n6/20:3n6) C63H106O6 LKKZTOWNYBYTMN-JPHWEMSBSA-N -HMDB0053500 956.783291069 TG(20:2n6/20:3n6/20:4(5Z,8Z,11Z,14Z)) C63H104O6 PUCACZUVSXLWRS-CPGGZKEOSA-N -HMDB0053506 956.783291069 TG(20:2n6/20:3n6/20:4(8Z,11Z,14Z,17Z)) C63H104O6 MHNHYVCCWTUPKM-MWTXPWPNSA-N -HMDB0053507 954.767641004 TG(20:2n6/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 RYRQCSWRSANYFM-VRVPOFQWSA-N -HMDB0053509 980.783291069 TG(20:2n6/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 IYWYZXDESMKWHJ-HZILPADHSA-N -HMDB0053511 958.798941133 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/20:2n6) C63H106O6 NBIMQFDILFVFBB-JEMAEXNRSA-N -HMDB0053512 956.783291069 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/20:3n6) C63H104O6 MOTVJOAHEUKKRZ-YESYEGNTSA-N -HMDB0053513 954.767641004 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 PICADWPLIJJOOG-NSHBGJPNSA-N -HMDB0053516 980.783291069 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 ANLTWDYCKOTMFG-HVEBEDGHSA-N -HMDB0053519 954.767641004 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 PDOINEZJPOJSCI-ZMMQLPKBSA-N -HMDB0053520 952.75199094 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 ONZPXYMTASPSNP-CETAVCOESA-N -HMDB0053521 980.783291069 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 YKAWRFAUPATMGP-TYMUZGDTSA-N -HMDB0053522 978.767641004 TG(20:2n6/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 WJUAWPOIGFVUDB-JUAVMTKGSA-N -HMDB0053531 958.798941133 TG(20:2n6/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 GSLBJFYKPXLMFL-IKXOKERUSA-N -HMDB0053536 952.882276835 TG(20:2n6/22:2(13Z,16Z)/o-18:0) C63H116O5 GAGJUGUZOUXSIF-XUAJFUSCSA-N -HMDB0053543 956.783291069 TG(20:2n6/22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H104O6 WFZKPKXMTUTJCU-IOYIGGFTSA-N -HMDB0053544 954.767641004 TG(20:2n6/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H102O6 HKWUREQRVPUWQW-OGEWLPAWSA-N -HMDB0053546 980.783291069 TG(20:2n6/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H104O6 JHULUDGYWIJGEI-JKMAUBRESA-N -HMDB0053549 948.850976706 TG(20:2n6/22:4(7Z,10Z,13Z,16Z)/o-18:0) C63H112O5 JFCUMDGUAUVTSM-WPIOGYDOSA-N -HMDB0053552 980.783291069 TG(20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C65H104O6 UHTSPOGAADMXJF-WPQFQGKGSA-N -HMDB0053556 954.767641004 TG(20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H102O6 WJRHNBWETKCFPT-PROAMFOBSA-N -HMDB0053557 952.75199094 TG(20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H100O6 HGVUWOFDDHGBHN-MHNCWGQHSA-N -HMDB0053558 980.783291069 TG(20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C65H104O6 IIAFUSNBHNDBCQ-KRAOBSJVSA-N -HMDB0053559 978.767641004 TG(20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H102O6 GZVGKSYTMGJZSJ-ADOPCIHKSA-N -HMDB0053567 956.783291069 TG(20:2n6/18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 WTQILBUQTSQKMT-NEZZOGGBSA-N -HMDB0053568 954.767641004 TG(20:2n6/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 MGEWHJIKKLGUTH-DHQUHFJFSA-N -HMDB0053570 900.720690811 TG(20:2n6/18:3(9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 DUPNCGTUAKCMPW-PASZNTQVSA-N -HMDB0053573 954.767641004 TG(20:2n6/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 GZIHTRQEPYSJHZ-YLRFTESRSA-N -HMDB0053574 952.75199094 TG(20:2n6/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 HFOUMPWZUOGOLE-WUBXHPFTSA-N -HMDB0053579 958.798941133 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)) C63H106O6 WDFUGSQAEFPRPL-UMPBKPLSSA-N -HMDB0053580 954.767641004 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 AQXUMBSYJVJRPS-HRYWBSIUSA-N -HMDB0053581 952.75199094 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 XQBXFBYULTYXBQ-RJJLYDRESA-N -HMDB0053582 900.720690811 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/18:3(9Z,12Z,15Z)) C59H96O6 BXWMIUIQFYBSNA-HVLDVOEXSA-N -HMDB0053585 924.720690811 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 ADUPVYSRXHTHNB-JUZJPHBYSA-N -HMDB0053586 952.75199094 TG(20:2n6/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 BPRZFYNWCPHLBU-ZZKGGULLSA-N -HMDB0053589 958.798941133 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/20:2n6) C63H106O6 LDWACUWXECAMNZ-XITXPYGISA-N -HMDB0053590 956.783291069 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/20:3n6) C63H104O6 XBOGPRFREBREQV-YQZJHLEBSA-N -HMDB0053591 954.767641004 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 IIRSRGQBHXKFQZ-GNOBDRPCSA-N -HMDB0053594 980.783291069 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 XEDWMKBQXWAUCP-JZYJTXSZSA-N -HMDB0053597 954.767641004 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 DKSGCJPLSFCQNA-OOIUYSHRSA-N -HMDB0053598 952.75199094 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 DQGFYDHZNGKRQX-ZZYVAGOISA-N -HMDB0053599 980.783291069 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 DOKOWFJDKWKLFD-LCRMNJBDSA-N -HMDB0053600 978.767641004 TG(20:2n6/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 ZOBKWRBFUOHRSY-GQQYBDHPSA-N -HMDB0053602 956.783291069 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/20:2n6) C63H104O6 XCCCZEHGAYDWGO-CWFQFOAQSA-N -HMDB0053603 954.767641004 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6) C63H102O6 XJKZLKNQUBHNFP-SZCNVQSISA-N -HMDB0053604 952.75199094 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 KWHSDMISQPUQKM-KACIZCAKSA-N -HMDB0053606 980.783291069 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 CQNHRJUJTGXQQC-UAEDNCFNSA-N -HMDB0053607 978.767641004 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 XEOSAHGABTVYIL-YDTCVEMJSA-N -HMDB0053609 924.720690811 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 ZEZMNCGRCXZDOR-QGPKCQKKSA-N -HMDB0053610 952.75199094 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 RTNVVKOTXGJPGJ-MRLIGENJSA-N -HMDB0053612 978.767641004 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 OUUACZFEHKKSHC-FIISSLSVSA-N -HMDB0053613 976.75199094 TG(20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 LVULGVDFRMCAJP-OOLMCXGKSA-N -HMDB0053617 980.783291069 TG(20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C65H104O6 ONLNESNWMKDEPS-QBUIFPKZSA-N -HMDB0053621 954.767641004 TG(20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C63H102O6 IUKFCSZXWLWVSV-CREAHHFCSA-N -HMDB0053622 952.75199094 TG(20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C63H100O6 IIRNIPXWMCLIGN-XJJVWCPNSA-N -HMDB0053623 980.783291069 TG(20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C65H104O6 XPIVVSMKOZXPFD-JCFGAGDNSA-N -HMDB0053624 978.767641004 TG(20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H102O6 XAEFFNXDYZHTNN-GPHGJLLNSA-N -HMDB0053629 980.783291069 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6) C65H104O6 JAYITAIAYFOYRP-MAIKJOQESA-N -HMDB0053630 978.767641004 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C65H102O6 RJFWEPAZVRIOOH-BSADJIHGSA-N -HMDB0053634 952.75199094 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C63H100O6 LNLUHLHHOCNFLS-XIVQVKPWSA-N -HMDB0053636 978.767641004 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 GBIRFFFMSPKFEB-KAYSYWCHSA-N -HMDB0053637 976.75199094 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 XKOVFTWOPGPYGI-FRJFTXROSA-N -HMDB0053640 944.819676578 TG(20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H108O5 LFYKQFUOADHDTL-WNQBHAGNSA-N -HMDB0053641 924.850976706 TG(20:2n6/o-18:0/20:2n6) C61H112O5 HMPAWVATDNDSKT-XEUHHCTMSA-N -HMDB0053644 952.882276835 TG(20:2n6/o-18:0/22:2(13Z,16Z)) C63H116O5 OYMCEAZYNJCWPE-FLXJHXBXSA-N -HMDB0053645 948.850976706 TG(20:2n6/o-18:0/22:4(7Z,10Z,13Z,16Z)) C63H112O5 RKZJFNKVHZZJGE-QHPKUKEUSA-N -HMDB0053652 944.819676578 TG(20:2n6/o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H108O5 HIZPZYVVCLXNRY-VCJZFQNSSA-N -HMDB0053663 900.720690811 TG(20:3n6/14:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C59H96O6 ROGPEDYCAOGILA-QFAXZWRLSA-N -HMDB0053664 842.772726384 TG(20:3n6/14:0/o-18:0) C55H102O5 WWBWZANTQJGIBV-FQZFNFCTSA-N -HMDB0053688 870.804026513 TG(20:3n6/16:0/o-18:0) C57H106O5 CWLXAXNJGBVGCW-CQKBLQMKSA-N -HMDB0053691 964.845891326 TG(20:3n6/18:0/22:2(13Z,16Z)) C63H112O6 QNCBCQOFCIRMDR-BSNFIWSJSA-N -HMDB0053693 958.798941133 TG(20:3n6/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H106O6 FJUCHGYLVVMEGA-PWVVNWSCSA-N -HMDB0053698 958.798941133 TG(20:3n6/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H106O6 NUEYLMZDBXYDET-KJQUGCBZSA-N -HMDB0053699 956.783291069 TG(20:3n6/18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H104O6 KDRWOUSNZBDXFR-SDPTVNQASA-N -HMDB0053701 962.830241252 TG(20:3n6/20:0/20:3n6) C63H110O6 ZMJSZQBPVUGYMY-KUCWVPRQSA-N -HMDB0053709 958.798941133 TG(20:3n6/20:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 SHWNHSAKNIOPPW-NPGRYNPDSA-N -HMDB0053712 926.866626771 TG(20:3n6/20:0/o-18:0) C61H114O5 IYTSSWXSXRRTMI-HIVQLAITSA-N -HMDB0053718 962.830241262 TG(20:3n6/22:0/18:3(9Z,12Z,15Z)) C63H110O6 UZIKBSYQATZXML-COEDDZBISA-N -HMDB0053724 954.8979269 TG(20:3n6/22:0/o-18:0) C63H118O5 YCGDLABDDKGWQV-LWEOUFGKSA-N -HMDB0053741 900.720690811 TG(20:3n6/14:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 OACZMCYGLSBUJM-AJZCWOQOSA-N -HMDB0053746 900.720690811 TG(20:3n6/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 FPSHTYJHVSXLOR-MOHFFBQJSA-N -HMDB0053757 900.720690811 TG(20:3n6/16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 WZOAXQSXOUDVTF-KAFXWOSWSA-N -HMDB0053760 868.788376449 TG(20:3n6/16:1(9Z)/o-18:0) C57H104O5 QTTCWZLTKUELKJ-AHPWZIASSA-N -HMDB0053763 962.830241262 TG(20:3n6/18:1(11Z)/22:2(13Z,16Z)) C63H110O6 DMKPIBYZJMFWDC-LKQRGGNSSA-N -HMDB0053764 958.798941133 TG(20:3n6/18:1(11Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 VNYZFOSXECUIIP-NYKVWDLNSA-N -HMDB0053765 956.783291069 TG(20:3n6/18:1(11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 XBJZPTQZKFLWMM-FXBZAVOSSA-N -HMDB0053770 956.783291069 TG(20:3n6/18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 OPWCVQYBFRNZGW-RSQVNEHNSA-N -HMDB0053771 954.767641004 TG(20:3n6/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 LRVVKNMHUSRKTM-QQKNVSGFSA-N -HMDB0053775 962.830241262 TG(20:3n6/18:1(9Z)/22:2(13Z,16Z)) C63H110O6 JKJYIRPZZWLYSB-PAKOHNFFSA-N -HMDB0053776 958.798941133 TG(20:3n6/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H106O6 BDCZEXNOCSGQCL-OZTKMVHISA-N -HMDB0053777 956.783291069 TG(20:3n6/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 WOEWLVSANLVPBT-PGSDUANMSA-N -HMDB0053782 956.783291069 TG(20:3n6/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 SINMBGNDNFVNCB-QOALKQDWSA-N -HMDB0053783 954.767641004 TG(20:3n6/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 HXTJEHRYNIVMJO-LDCCXADYSA-N -HMDB0053786 958.798941133 TG(20:3n6/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H106O6 PPBRPZLEEGPJRP-ZBMIMYGISA-N -HMDB0053792 958.798941133 TG(20:3n6/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 QOCFTCUMNUGLBB-CWJHHOMOSA-N -HMDB0053793 956.783291069 TG(20:3n6/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 HCNIXAHXARQCOB-HZBHBOJCSA-N -HMDB0053796 924.850976706 TG(20:3n6/20:1(11Z)/o-18:0) C61H112O5 XWCJBYCREBJYKA-PJQDDADQSA-N -HMDB0053797 956.78329106 TG(20:3n6/20:3(5Z,8Z,11Z)/20:3n6) C63H104O6 SGITZBIAHRILMB-OCHWCUPNSA-N -HMDB0053798 954.767641004 TG(20:3n6/20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)) C63H102O6 LETCSCFPJVUIQT-DZROGVPMSA-N -HMDB0053801 980.783291069 TG(20:3n6/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 BQOHWEWPDQAKRD-ONJUIKPZSA-N -HMDB0053804 954.767641004 TG(20:3n6/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 ISVPYEPJNJNVKN-WZOKJXESSA-N -HMDB0053805 952.75199094 TG(20:3n6/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 LCJYOCKCVAVOGU-AZMKZBGGSA-N -HMDB0053806 980.783291069 TG(20:3n6/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 GBMUQJHBAYXLFF-QQDMDJKTSA-N -HMDB0053807 978.767641004 TG(20:3n6/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 NCZKUPMKYLKXLD-ANUHHRAWSA-N -HMDB0053815 958.798941133 TG(20:3n6/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 BEAIEHHBBTZBNH-CCEATODJSA-N -HMDB0053820 952.882276835 TG(20:3n6/22:1(13Z)/o-18:0) C63H116O5 GQESZZRPJKPSPA-ZHJDXWBJSA-N -HMDB0053836 956.783291069 TG(20:3n6/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 BNQJQBHYOORHQK-URQCDWBRSA-N -HMDB0053837 954.767641004 TG(20:3n6/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 GRDDVYHFHJYAIG-HXPWBUJHSA-N -HMDB0053839 900.720690811 TG(20:3n6/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 LJQQNDOWXYVVGF-DNUBYABRSA-N -HMDB0053842 954.767641004 TG(20:3n6/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 LBPWGTZIEHPYML-KTNNRGRNSA-N -HMDB0053843 952.75199094 TG(20:3n6/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 ZMMKASYZFJCWTE-IUMWOJOHSA-N -HMDB0053847 958.798941133 TG(20:3n6/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C63H106O6 IJCNKBUZXXINLK-ZALHMPRVSA-N -HMDB0053848 954.767641004 TG(20:3n6/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 YUKFMIGMRRYIPC-MHWKCNDWSA-N -HMDB0053849 952.75199094 TG(20:3n6/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 RYZZITBQUSKDOJ-ZABFSXBSSA-N -HMDB0053850 900.720690811 TG(20:3n6/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)) C59H96O6 PMIXGVBCAUCGTR-VZNZLLHPSA-N -HMDB0053853 924.720690811 TG(20:3n6/18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 ZMDJDWQCIRBXLN-FVIVEPGNSA-N -HMDB0053854 952.75199094 TG(20:3n6/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 DETNYSOCAKGVMQ-GFYHCCGQSA-N -HMDB0053857 958.798941133 TG(20:3n6/20:2n6/20:3n6) C63H106O6 TXWFFTTYLKQWRO-LHFHLTMTSA-N -HMDB0053858 956.783291069 TG(20:3n6/20:2n6/20:4(5Z,8Z,11Z,14Z)) C63H104O6 AUJUYSXBGAUAGJ-HNBAHIJOSA-N -HMDB0053864 956.783291069 TG(20:3n6/20:2n6/20:4(8Z,11Z,14Z,17Z)) C63H104O6 QANZEVFDXQPYRW-DMBWBKAFSA-N -HMDB0053865 954.767641004 TG(20:3n6/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 UTLDFQYGOHSAKY-PGXLCAQDSA-N -HMDB0053867 980.783291069 TG(20:3n6/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 LXJFDHZCAKDNRX-LJGMGBEESA-N -HMDB0053869 956.78329106 TG(20:3n6/20:3n6/20:3n6) C63H104O6 PMEABGYOVGWCSQ-OWSTVCCQSA-N -HMDB0053870 954.767641004 TG(20:3n6/20:3n6/20:4(5Z,8Z,11Z,14Z)) C63H102O6 LLTRXGBFCHGGPQ-CVXVAJIWSA-N -HMDB0053873 980.783291069 TG(20:3n6/20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 SQNFAMFCWLTXBP-NYQJKXRGSA-N -HMDB0053876 954.767641004 TG(20:3n6/20:3n6/20:4(8Z,11Z,14Z,17Z)) C63H102O6 VZTQVMWXBQJQFL-CJCBZHARSA-N -HMDB0053877 952.75199094 TG(20:3n6/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 GQUORQBURNYKNQ-GABGCZDCSA-N -HMDB0053878 980.783291069 TG(20:3n6/20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 VIBIIAUIZFMPDA-GOUXSMMJSA-N -HMDB0053879 978.767641004 TG(20:3n6/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 XXDBJHDRECUBNX-ANONBXLESA-N -HMDB0053881 954.767640996 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/20:3n6) C63H102O6 KHKICBDLNWOYFV-MNBRBKMYSA-N -HMDB0053882 952.75199094 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 ASSZWZBQIXMMKM-ZDOQARJHSA-N -HMDB0053884 980.783291069 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 YEWJAWDCDPEWJL-AYSYXUHPSA-N -HMDB0053885 978.767641004 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 OSKYXBRDUUVYGA-KAJIBNBASA-N -HMDB0053887 924.720690811 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 IIGHVRSTPXBBKS-SYYVHDBGSA-N -HMDB0053888 952.75199094 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 DPVRRBMNBIRJAB-QXRFJFNQSA-N -HMDB0053890 978.767641004 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 ILKSJOCYCMKEPF-SIMCWUMKSA-N -HMDB0053891 976.75199094 TG(20:3n6/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 XMWUXAVIWIDJNZ-DYLAYEMXSA-N -HMDB0053898 958.798941133 TG(20:3n6/22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C63H106O6 OBIZTMOHZKQECQ-BTJAXQBVSA-N -HMDB0053899 956.783291069 TG(20:3n6/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 WKMJVPNNZRZPKK-BAFIBNSUSA-N -HMDB0053904 950.866626771 TG(20:3n6/22:2(13Z,16Z)/o-18:0) C63H114O5 ROYJPPZMPGNTCP-VKWATNDDSA-N -HMDB0053906 980.783291069 TG(20:3n6/22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C65H104O6 MUNBPCWOOXLCTN-HNYIGLNKSA-N -HMDB0053910 954.767641004 TG(20:3n6/22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H102O6 FBVWZRNWVYGXSE-FGLBZDJESA-N -HMDB0053911 952.75199094 TG(20:3n6/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H100O6 FYXMPUDVYRLIIY-BLNHPGEGSA-N -HMDB0053912 980.783291069 TG(20:3n6/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C65H104O6 OIHKRHQEBBJGMC-ZZIBGWPQSA-N -HMDB0053913 978.767641004 TG(20:3n6/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H102O6 ITQKGJSZZRFPGO-KJSYODJUSA-N -HMDB0053917 980.78329106 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:3n6) C65H104O6 NWKWBJNWUOYDEU-ZVSHCWITSA-N -HMDB0053918 978.767641004 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C65H102O6 GYKIUAHHSLWRCC-VDLLWIKLSA-N -HMDB0053922 952.75199094 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H100O6 VQUDVLRTBZFPSP-UGEMLECESA-N -HMDB0053924 978.767641004 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 UBRHQUSYUSSYQB-KMTXAPROSA-N -HMDB0053925 976.75199094 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 VMXDSQGCSDZBPH-ULZQOEFTSA-N -HMDB0053928 944.819676578 TG(20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)/o-18:0) C63H108O5 VCEGRHVWRBJANM-HHHVJZPPSA-N -HMDB0053931 958.798941133 TG(20:3n6/18:3(9Z,12Z,15Z)/22:2(13Z,16Z)) C63H106O6 VLEBBCZZNDWVCE-YFDHYPGRSA-N -HMDB0053932 954.767641004 TG(20:3n6/18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 XRPOIBHTJJIOON-DARGTILLSA-N -HMDB0053933 952.75199094 TG(20:3n6/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 NSHUKAOTMWTYBG-AHQXEEQZSA-N -HMDB0053934 900.720690811 TG(20:3n6/18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)) C59H96O6 IOBBMTADSCMSQV-JQJOXGKYSA-N -HMDB0053937 924.720690811 TG(20:3n6/18:3(9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 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TG(20:3n6/20:4(8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 QVXNVPNSDDBRRI-LIDBKKNKSA-N -HMDB0053959 924.720690811 TG(20:3n6/20:4(8Z,11Z,14Z,17Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 BFHIXYFKXXDKJA-XKSFJAGQSA-N -HMDB0053960 952.75199094 TG(20:3n6/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 XLHCXTOOFJLBCC-SEDUIMLTSA-N -HMDB0053962 978.767641004 TG(20:3n6/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 AJBJMZWRBVANHW-OFCWBGGOSA-N -HMDB0053963 976.75199094 TG(20:3n6/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 WEIYGRYZWZVJNM-WJXRSXAVSA-N -HMDB0053965 952.751990932 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6) C63H100O6 AYUYHZRNTHHDTD-XGEZYAKSSA-N -HMDB0053968 978.767641004 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C65H102O6 REAOSGOGZMYBES-VWOCJVGSSA-N -HMDB0053969 976.75199094 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H100O6 UPFPFVNSYAIZPP-RFWSHMJTSA-N -HMDB0053970 924.720690811 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/18:3(9Z,12Z,15Z)) C61H96O6 ZDCGUXVHJZWSQH-PZTSOPGCSA-N -HMDB0053974 976.75199094 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 ZNNSZCOJOITELJ-SOYIOSQGSA-N -HMDB0053975 974.736340876 TG(20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 QFZJQQLNNQGHMX-HELFZQAVSA-N -HMDB0053977 980.78329106 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:3n6) C65H104O6 MELJTHJAZJCCBG-IGNWFMMUSA-N -HMDB0053978 978.767641004 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C65H102O6 VLIZDRAULWCXJB-IPRYEMCPSA-N -HMDB0053982 952.75199094 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C63H100O6 XNMDOQDBXJDBNN-WUHYUBCTSA-N -HMDB0053984 978.767641004 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 HBSUKMPAVQMSND-WDIOCQAOSA-N -HMDB0053985 976.75199094 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 YMJYQRKUQPYKQY-BFUASZMRSA-N -HMDB0053988 944.819676578 TG(20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)/o-18:0) 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TG(20:3n6/o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H106O5 LFUPLKNUYGXDCB-DBMCQXJOSA-N -HMDB0054015 900.720690811 TG(20:4(5Z,8Z,11Z,14Z)/14:0/22:5(4Z,7Z,10Z,13Z,16Z)) C59H96O6 PVWLIUKXMYHSER-URGFWJIKSA-N -HMDB0054020 900.720690811 TG(20:4(5Z,8Z,11Z,14Z)/14:0/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 HVCHCPBXTHVCNG-LAKYEWMPSA-N -HMDB0054041 900.720690811 TG(20:4(5Z,8Z,11Z,14Z)/16:0/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 ZWLJFCNGDYASKC-OBDRUBOPSA-N -HMDB0054044 868.788376449 TG(20:4(5Z,8Z,11Z,14Z)/16:0/o-18:0) C57H104O5 FOYFALOBIYPIPL-UKAGANHESA-N -HMDB0054046 962.830241262 TG(20:4(5Z,8Z,11Z,14Z)/18:0/22:2(13Z,16Z)) C63H110O6 WDEZMXSFPUWTDB-XNIVQZDQSA-N -HMDB0054047 958.798941133 TG(20:4(5Z,8Z,11Z,14Z)/18:0/22:4(7Z,10Z,13Z,16Z)) C63H106O6 XLTFKKGEFQUZDB-SZCSOAHHSA-N -HMDB0054048 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/18:0/22:5(4Z,7Z,10Z,13Z,16Z)) C63H104O6 NTFIQEWZDSXEJP-RZXDWUBUSA-N -HMDB0054053 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 UCROWURDULDTCP-LDBBTXTCSA-N 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952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 WJPRJNAUQKKXCZ-GCLWRPFOSA-N -HMDB0054121 894.804026513 TG(20:4(5Z,8Z,11Z,14Z)/18:1(11Z)/o-18:0) C59H106O5 ZSUORVUZOXBKRZ-RCDIBCAKSA-N -HMDB0054124 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C63H104O6 MDNOGAANWQBLFP-IJFRLCCNSA-N -HMDB0054125 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H102O6 QNUYKUIODKHOPQ-LTKDXQLGSA-N -HMDB0054127 900.720690811 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/18:4(6Z,9Z,12Z,15Z)) C59H96O6 PHESVRVAJGWCRH-TVNBWLDXSA-N -HMDB0054132 894.804026513 TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/o-18:0) C59H106O5 ZMLLSDUMFIKCFD-NXFFUJLKSA-N -HMDB0054133 956.78329106 TG(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) C63H104O6 HRTPJAKAPLEWKW-SHOSPWABSA-N -HMDB0054139 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 QUQKNNJGHQORGA-JNIPZRFQSA-N -HMDB0054140 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 IKPPMXCWNQRCFS-KZBAZKMJSA-N -HMDB0054142 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 SDAUBXOTWVTLJM-JXMGCOESSA-N -HMDB0054144 952.751990932 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/20:4(5Z,8Z,11Z,14Z)) C63H100O6 QGITUKCHSUMQKN-SRGITURZSA-N -HMDB0054146 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 AHQZELFLVJXKCX-HDYOPKQBSA-N -HMDB0054147 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 YLUCRQKSSLJBCX-URPYBCRMSA-N -HMDB0054149 924.720690811 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 QXEZXNMXRFVAHQ-GREDEARISA-N -HMDB0054150 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 LBGUIRKHHMWLGW-JMJFNZKKSA-N -HMDB0054152 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 BXLAGUWZJCEHDF-HTHUGMHNSA-N -HMDB0054153 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 LFVJCEBDOJPSTJ-QIRSXJMZSA-N -HMDB0054159 958.798941133 TG(20:4(5Z,8Z,11Z,14Z)/22:1(13Z)/18:3(9Z,12Z,15Z)) C63H106O6 GOCVRJSMLHXZOM-BHMLRGKUSA-N -HMDB0054160 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/22:1(13Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 YFGCWKHYYCNTFA-PNKSXRIYSA-N -HMDB0054165 950.866626771 TG(20:4(5Z,8Z,11Z,14Z)/22:1(13Z)/o-18:0) C63H114O5 PVIAPLQIFDZWHV-TUGJCTNUSA-N -HMDB0054178 958.798941133 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/22:2(13Z,16Z)) C63H106O6 IMMKDABJSSZNBN-NNJUFJIYSA-N -HMDB0054179 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H102O6 IEJHTHOZNZVRKD-HBCKGLLNSA-N -HMDB0054180 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C63H100O6 VDKWOOLRBVQGKK-MFVGGNPTSA-N -HMDB0054188 924.720690804 TG(20:4(5Z,8Z,11Z,14Z)/18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,14Z)) C61H96O6 LORJDMOYIBFNHP-JOFQGOHGSA-N -HMDB0054189 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/18:3(6Z,9Z,12Z)/22:2(13Z,16Z)) C63H104O6 GOBSVYLENLQESQ-NFIMDJPESA-N -HMDB0054190 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/18:3(6Z,9Z,12Z)/22:4(7Z,10Z,13Z,16Z)) C63H100O6 WEMUYPQCMUSKDO-IGTMGBHISA-N -HMDB0054194 924.720690811 TG(20:4(5Z,8Z,11Z,14Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C61H96O6 GWEURXHGUZNRIT-JOTCGIDNSA-N -HMDB0054199 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/20:4(5Z,8Z,11Z,14Z)) C63H102O6 PSSHOBGHPGDGSV-UEDOWZHKSA-N -HMDB0054202 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 AKGKDADGQVDJFQ-IMIHIDGKSA-N -HMDB0054205 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/20:4(8Z,11Z,14Z,17Z)) C63H102O6 RFNMQGVASYUQRC-IBYPJWTQSA-N -HMDB0054206 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 IYWKHVMWOJKUJQ-FWFDRGOBSA-N -HMDB0054207 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 KVYXNXVDUNZWSJ-FNNKRFCDSA-N -HMDB0054208 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 PPOTXXPYDKRBFX-XGGWUGDISA-N -HMDB0054210 952.751990932 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/20:4(5Z,8Z,11Z,14Z)) C63H100O6 HHRQBQZQQLMORJ-WTNBNRNLSA-N -HMDB0054212 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/22:4(7Z,10Z,13Z,16Z)) C65H104O6 QZKVXJMSEGENRO-DUUKHDKXSA-N -HMDB0054213 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 YJMGXZYEPBQBAS-RHMXECJUSA-N -HMDB0054215 924.720690811 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/18:4(6Z,9Z,12Z,15Z)) C61H96O6 OADRPNFNIMRMSJ-IYLHTVELSA-N -HMDB0054216 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/20:4(8Z,11Z,14Z,17Z)) C63H100O6 ABVLJQVWYOLQMF-GYOCQHIKSA-N -HMDB0054218 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 KAEODHZECKFAMI-HKTXDWKRSA-N -HMDB0054219 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 JZCOYMPHNKEFBL-OOQCWDLUSA-N -HMDB0054223 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)) C65H102O6 DLGNQYNTHSLLTF-KPZKUVPUSA-N -HMDB0054224 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H100O6 KRLQJAOQAHGFBW-NNCYRJSESA-N -HMDB0054229 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 RBZWPWOMYYQLGS-MNETUWDNSA-N -HMDB0054236 956.783291069 TG(20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)/18:3(9Z,12Z,15Z)) C63H104O6 VRQORPMJTGLJIF-KVHBMALXSA-N -HMDB0054237 954.767641004 TG(20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C63H102O6 CXUAFHKFYPZCJF-GTDXWILQSA-N -HMDB0054239 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H104O6 WUOIZTCKOHESSM-YDAOOVGJSA-N -HMDB0054242 948.850976706 TG(20:4(5Z,8Z,11Z,14Z)/22:2(13Z,16Z)/o-18:0) C63H112O5 FWZUXHAVUFTVEK-VRJAMGGUSA-N -HMDB0054243 978.767640996 TG(20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C65H102O6 ZCXFXSOZEDCKII-DIUXQMCQSA-N -HMDB0054247 952.75199094 TG(20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C63H100O6 XJSRQCYRQHWNOX-POCDRFPSSA-N -HMDB0054249 978.767641004 TG(20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 JMDOVHGZTAWIRS-FPVWWCCKSA-N -HMDB0054250 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 LOHAZCBURLHRGA-FJSQIZSJSA-N -HMDB0054253 944.819676578 TG(20:4(5Z,8Z,11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/o-18:0) C63H108O5 IWAAHSCTDZFCMG-SEVCLUMKSA-N -HMDB0054254 976.751990932 TG(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)) C65H100O6 BOCXQLMOUDZMLY-XZHLMPLWSA-N -HMDB0054260 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C65H100O6 KBIZWAIRBWIMJH-WEXFHPIHSA-N -HMDB0054261 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H98O6 UFZCYUBETGBVRN-YYFWOMMFSA-N -HMDB0054264 942.804026513 TG(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/o-18:0) C63H106O5 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C61H96O6 DKHXDEWODXYNLT-JPWRGKLZSA-N -HMDB0054295 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 MHUAVEYSFKXLTQ-HTQBSBCMSA-N -HMDB0054296 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 UBWVHRBREHBARK-KTUPTMNHSA-N -HMDB0054299 980.783291069 TG(20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) C65H104O6 MIHUZKOKUAIBTL-JTGMEFRQSA-N -HMDB0054300 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) C65H100O6 IFFCQSDSZZCHHD-CMIIIZKFSA-N -HMDB0054301 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H98O6 RQKHMPSZDUHCED-ZXSGSBBZSA-N -HMDB0054306 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H98O6 MLGSATAFRBQCQT-NGMUZLJMSA-N -HMDB0054309 976.751990932 TG(20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C65H100O6 YXINJZXUPUXLPR-XCBFJODPSA-N -HMDB0054315 976.75199094 TG(20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C65H100O6 PWGSYNKICGOQAF-LGWCTTQKSA-N -HMDB0054316 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H98O6 GWSGWHHWROFTDI-QKPNHJSTSA-N -HMDB0054319 942.804026513 TG(20:4(5Z,8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H106O5 OUDIBODAEFRRMK-XBXVJNCPSA-N -HMDB0054320 974.736340868 TG(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)) C65H98O6 DXMMCRIFBAEJJI-OZROQBHKSA-N -HMDB0054326 974.736340876 TG(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)) C65H98O6 YQBJSWUNYSIELN-CMHGXLFBSA-N -HMDB0054330 940.788376449 TG(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C63H104O5 LHOPPWWFGCZSQE-SWJWPVIXSA-N -HMDB0054332 948.850976706 TG(20:4(5Z,8Z,11Z,14Z)/o-18:0/22:2(13Z,16Z)) C63H112O5 OIZPCGDUHJZSMK-HAHZAOLMSA-N -HMDB0054333 944.819676578 TG(20:4(5Z,8Z,11Z,14Z)/o-18:0/22:4(7Z,10Z,13Z,16Z)) C63H108O5 QYDUYXRVYKJXAF-ZTDQSZJWSA-N 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TG(22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 ZAXBGJFTPBBLPV-MCEHBTKTSA-N -HMDB0054816 976.75199094 TG(22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 FSGXRGDLAOPONC-MSDNTJRMSA-N -HMDB0054819 944.819676578 TG(22:4(7Z,10Z,13Z,16Z)/20:4(5Z,8Z,11Z,14Z)/o-18:0) C63H108O5 XSUFNQFSNOZPJJ-YHRACOEDSA-N -HMDB0054831 980.783291069 TG(22:4(7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C65H104O6 PRNTVSSKPYNQFB-XCZNIMLYSA-N -HMDB0054832 978.767641004 TG(22:4(7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C65H102O6 MGQQPWQKHKOPLE-RYVHMWHKSA-N -HMDB0054840 978.767641004 TG(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C65H102O6 YXJDHTLWZURQQQ-BJDFVIDNSA-N -HMDB0054841 976.75199094 TG(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C65H100O6 ZZTADPGUNQYDJV-SKJNIZBXSA-N -HMDB0054847 980.78329106 TG(22:4(7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)) C65H104O6 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TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 HFBJTSRFGJNOKC-YIEKUZANSA-N -HMDB0054989 980.78329106 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H104O6 MFXICCJOWPGOMM-XADRRCKOSA-N -HMDB0054992 954.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 NEGZJZAROHNABH-NZTUCVBGSA-N -HMDB0054993 952.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 WIPJLCNBSDRPCH-AETOJOLRSA-N -HMDB0054994 980.783291069 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 CBWHWKJXJAEZSY-XLFHJXSESA-N -HMDB0054995 978.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 LBZFYZRIVKZJJE-ZGBNUKLUSA-N -HMDB0054998 956.783291069 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)/18:3(9Z,12Z,15Z)) C63H104O6 FTPIEUFVUCYXLP-XXTCXCIGSA-N -HMDB0054999 954.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)/18:4(6Z,9Z,12Z,15Z)) C63H102O6 ZQHGMYAPBUGFGH-BKQSWIQXSA-N -HMDB0055001 980.783291069 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H104O6 PKOCESNOUDACBL-ZNESULDZSA-N -HMDB0055004 948.850976706 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:1(11Z)/o-18:0) C63H112O5 PUZHVGYKYYGDMS-JMRFTNCESA-N -HMDB0055006 952.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)/18:3(9Z,12Z,15Z)) C63H100O6 HLYYLRJCOCUOTF-PZSGASPQSA-N -HMDB0055008 978.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)/20:4(8Z,11Z,14Z,17Z)) C65H102O6 OIOGHITYHSZJFT-GWSCWNJSSA-N -HMDB0055009 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H100O6 WAPIAFALOIFIDE-FGFFKGABSA-N -HMDB0055012 944.819676578 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:3(5Z,8Z,11Z)/o-18:0) C63H108O5 IPPJSXWXPGLCQK-LLLSDSOZSA-N -HMDB0055029 978.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:2(9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H102O6 MOBYCDUVYHPIKW-QTUVSTJQSA-N -HMDB0055031 924.720690811 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:2(9Z,12Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 VDBKGOXLBQIZPU-ASKNWMCUSA-N -HMDB0055032 952.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:2(9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 YVMNXNALYLASPR-OOMDIUAISA-N -HMDB0055034 978.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 OYSOIAGVLQBDQC-LJAQQNJASA-N -HMDB0055035 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 ZBZSGHOSBYKFMH-RAHPUFCRSA-N -HMDB0055037 976.751990932 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H100O6 JDZAHEZYIGRMEL-YLNHCUGNSA-N -HMDB0055038 924.720690811 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)/18:3(9Z,12Z,15Z)) C61H96O6 YXCZDJDWMGLROL-BTHKLLDPSA-N -HMDB0055042 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 XKMBJWDOLOADJZ-YXRWHZRRSA-N -HMDB0055043 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 BTWXUMBXWXULHV-PRPNHAAKSA-N -HMDB0055046 954.767641004 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:2n6/18:3(9Z,12Z,15Z)) C63H102O6 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TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H100O6 UPVISHBUYMKHRG-RJGVUJFSSA-N -HMDB0055094 924.720690811 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z)) C61H96O6 NKHUBYYMFGFTBT-YHQGAVFBSA-N -HMDB0055098 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 SNTGZWYCTMYTOD-AFKMUTBASA-N -HMDB0055099 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 VXWOYIMCGZLATM-FUVNPKLISA-N -HMDB0055101 974.736340868 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)) C65H98O6 NZGAHETUOKYLSV-KHVINVGPSA-N -HMDB0055106 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H98O6 UWQFVORTWFKSOT-NCLMAHQZSA-N -HMDB0055112 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C65H100O6 SRBSGDVVPHPNDO-VWALSOBTSA-N -HMDB0055113 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C65H98O6 ZWYPDEYRJRCIAW-HNVULPCWSA-N -HMDB0055116 942.804026513 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)/o-18:0) C63H106O5 BPAMRGTXFLHKIB-VYQSYQJESA-N -HMDB0055120 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C65H98O6 XPNIGQULVQXNOR-WGNGNYRNSA-N -HMDB0055124 940.788376449 TG(22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C63H104O5 SXUJRBNGKRSZMK-RSJZAVQJSA-N -HMDB0055126 976.75199094 TG(22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C65H100O6 SYWBOISBWLVQRM-DIYJIBIVSA-N -HMDB0055127 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)) C65H98O6 HGLWRMSTDIUKPJ-OBDYTBJUSA-N -HMDB0055134 974.736340876 TG(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C65H98O6 PJUXPSZIAMGJNO-KIQLQHRDSA-N -HMDB0055140 966.804026513 TG(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C65H106O5 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TG(18:3(9Z,12Z,15Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H106O6 RTQRXFBDRZBVFU-TYXQVQFXSA-N -HMDB0055189 926.866626771 TG(18:3(9Z,12Z,15Z)/22:0/o-18:0) C61H114O5 HBROMTOKCOWBCF-HAPINPQDSA-N -HMDB0055190 962.830241252 TG(18:3(9Z,12Z,15Z)/24:0/18:3(9Z,12Z,15Z)) C63H110O6 YZQJJIWXQVTOPY-VRUQJSDHSA-N -HMDB0055196 954.8979269 TG(18:3(9Z,12Z,15Z)/24:0/o-18:0) C63H118O5 MGVLRAKEBILBAC-KHKGUJNRSA-N -HMDB0055208 900.720690811 TG(18:3(9Z,12Z,15Z)/16:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 YEIYHQZOMAQZID-NQEISCIQSA-N -HMDB0055214 900.720690811 TG(18:3(9Z,12Z,15Z)/18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 OEMFAWUKBJFEBP-GIFQHGOPSA-N -HMDB0055217 868.788376449 TG(18:3(9Z,12Z,15Z)/18:1(11Z)/o-18:0) C57H104O5 YZUQGBAOTLBFFG-UXYCMECVSA-N -HMDB0055224 868.788376449 TG(18:3(9Z,12Z,15Z)/18:1(9Z)/o-18:0) C57H104O5 QKBOUSRTZKBNLJ-KJNSHSROSA-N -HMDB0055229 956.783291069 TG(18:3(9Z,12Z,15Z)/20:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 GGWFIQWJEZZPGR-RHSNWCIXSA-N -HMDB0055230 954.767641004 TG(18:3(9Z,12Z,15Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 ZOXUQQAZDPHQME-XHQZZLEISA-N -HMDB0055232 900.720690804 TG(18:3(9Z,12Z,15Z)/20:3(5Z,8Z,11Z)/18:3(9Z,12Z,15Z)) C59H96O6 HJZFUASFTDEZRS-PBGLDYIPSA-N -HMDB0055235 924.720690811 TG(18:3(9Z,12Z,15Z)/20:3(5Z,8Z,11Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 FBORIUPMVVLKEO-MWSZMMAXSA-N -HMDB0055236 952.75199094 TG(18:3(9Z,12Z,15Z)/20:3(5Z,8Z,11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 CDRRGEQBGHUNAB-PSSJFELOSA-N -HMDB0055241 958.798941133 TG(18:3(9Z,12Z,15Z)/22:1(13Z)/20:4(8Z,11Z,14Z,17Z)) C63H106O6 HKIUNKJCPJLXAN-NNDBZRKKSA-N -HMDB0055242 956.783291069 TG(18:3(9Z,12Z,15Z)/22:1(13Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 AXNLZGZTFCFLJT-AYGFEVJLSA-N -HMDB0055245 924.850976706 TG(18:3(9Z,12Z,15Z)/22:1(13Z)/o-18:0) C61H112O5 WVDRXDBKAJIUGG-NUNGZDAFSA-N -HMDB0055247 958.798941133 TG(18:3(9Z,12Z,15Z)/24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C63H106O6 DDMIXISYNHIHGW-MJBKJXDCSA-N -HMDB0055252 952.882276835 TG(18:3(9Z,12Z,15Z)/24:1(15Z)/o-18:0) C63H116O5 RROULMIXESFVQQ-BVNIRHBSSA-N -HMDB0055255 900.720690811 TG(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 KRCNTZDQJTVXHX-CWSHFURNSA-N -HMDB0055259 866.772726384 TG(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)/o-18:0) C57H102O5 DEOXWPGCLRDGFZ-MOXJRXQISA-N -HMDB0055264 924.720690811 TG(18:3(9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 ODPDZZJOACRCJQ-FYVAJUTISA-N -HMDB0055268 900.720690811 TG(18:3(9Z,12Z,15Z)/20:2n6/18:4(6Z,9Z,12Z,15Z)) C59H96O6 YPKAPKOHLOHKML-PASZNTQVSA-N -HMDB0055271 954.767641004 TG(18:3(9Z,12Z,15Z)/20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 FOQDWFDQDXPCLA-YLRFTESRSA-N -HMDB0055272 952.75199094 TG(18:3(9Z,12Z,15Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 VFFAIRLXZFVSMW-WUBXHPFTSA-N -HMDB0055274 900.720690804 TG(18:3(9Z,12Z,15Z)/20:3n6/18:3(9Z,12Z,15Z)) C59H96O6 RLGAOLRDHOLJNN-VTFCZUFISA-N -HMDB0055277 924.720690811 TG(18:3(9Z,12Z,15Z)/20:3n6/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 ZQLZCFZHBCBDQM-SKKWUDLLSA-N -HMDB0055278 952.75199094 TG(18:3(9Z,12Z,15Z)/20:3n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 BBJDEDZNDSLQPM-MWYIYXPCSA-N -HMDB0055283 924.720690811 TG(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)/20:4(8Z,11Z,14Z,17Z)) C61H96O6 YDRIITRYYSNHJE-PFNGUKLTSA-N -HMDB0055290 956.783291069 TG(18:3(9Z,12Z,15Z)/22:2(13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H104O6 VRDFIQSWUACISW-IZYNXEDNSA-N -HMDB0055291 954.767641004 TG(18:3(9Z,12Z,15Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H102O6 KAOUTJZLIDQIDJ-SVIMKBJRSA-N -HMDB0055293 980.783291069 TG(18:3(9Z,12Z,15Z)/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O6 PHBPVJUUYJZCOS-BTFSSQDWSA-N -HMDB0055296 924.720690811 TG(18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) C61H96O6 UFAIMASITNLXEW-PNUDZBTKSA-N -HMDB0055297 952.75199094 TG(18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H100O6 NQVAELCJJYGSJQ-AMXZYMOQSA-N -HMDB0055299 978.767641004 TG(18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H102O6 WFPDDMWARPVGSU-UBJYRDLHSA-N -HMDB0055300 976.75199094 TG(18:3(9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 MULNUHSRKPNWLL-XNNXLCRESA-N -HMDB0055302 924.720690804 TG(18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(9Z,12Z,15Z)) C61H96O6 CDMMBNHFKIGUCQ-LQRBBFFOSA-N -HMDB0055306 976.75199094 TG(18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 XWQYOJPOKGTBNZ-RBJJIACISA-N -HMDB0055307 974.736340876 TG(18:3(9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 RJQLMNLOMYMQTG-IJGMCPITSA-N -HMDB0055325 924.720690811 TG(18:3(9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)/20:4(8Z,11Z,14Z,17Z)) C61H96O6 ULMDLWOZXLWNSK-COGRUCQWSA-N -HMDB0055337 924.720690804 TG(18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)) C61H96O6 CHOVJZYSPBBQPK-ZBCFUSIVSA-N -HMDB0055341 976.75199094 TG(18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 TZHNFARYORXAOO-UHADCEBTSA-N -HMDB0055342 974.736340876 TG(18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 HDRSBEGKBHLZCW-RMXAKDHHSA-N -HMDB0055348 974.736340876 TG(18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H98O6 DKVBIZBAPFCQCD-RUIDFXLVSA-N -HMDB0055372 900.720690811 TG(18:4(6Z,9Z,12Z,15Z)/16:0/22:5(7Z,10Z,13Z,16Z,19Z)) C59H96O6 WFGBZGXKOVKMDE-BUQSLHTBSA-N -HMDB0055377 900.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C59H96O6 LOPISFWKDHPVGZ-RLKXHVNISA-N -HMDB0055380 868.788376449 TG(18:4(6Z,9Z,12Z,15Z)/18:0/o-18:0) C57H104O5 FDFREEAVFLANHV-FRVOMFDKSA-N -HMDB0055384 956.783291069 TG(18:4(6Z,9Z,12Z,15Z)/20:0/22:5(7Z,10Z,13Z,16Z,19Z)) C63H104O6 AOTFUYDDGGOHGP-YPNLPGCTSA-N -HMDB0055385 954.767641004 TG(18:4(6Z,9Z,12Z,15Z)/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H102O6 MLCGMLRNSFLNND-SLWMPKCOSA-N -HMDB0055388 958.798941133 TG(18:4(6Z,9Z,12Z,15Z)/22:0/20:4(8Z,11Z,14Z,17Z)) C63H106O6 MLBXOOYHYHHLQI-CGEBVKDKSA-N -HMDB0055389 956.783291069 TG(18:4(6Z,9Z,12Z,15Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z)) C63H104O6 PWMCWAZYXBHOKR-HLGYKAKVSA-N -HMDB0055392 924.850976706 TG(18:4(6Z,9Z,12Z,15Z)/22:0/o-18:0) C61H112O5 YOIYDGJMKJEXTG-ZGKFSGSJSA-N -HMDB0055393 958.798941124 TG(18:4(6Z,9Z,12Z,15Z)/24:0/18:4(6Z,9Z,12Z,15Z)) C63H106O6 XBZRFWSSSDXNCN-YSTZOJCNSA-N -HMDB0055398 952.882276835 TG(18:4(6Z,9Z,12Z,15Z)/24:0/o-18:0) C63H116O5 XQQJAGYYEVRLNX-GFAJMFIRSA-N -HMDB0055410 838.741426256 TG(18:4(6Z,9Z,12Z,15Z)/16:1(9Z)/o-18:0) C55H98O5 JTHKVFDOMHYCNA-AIUSJKFJSA-N -HMDB0055412 900.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 TZNCRMSXUPMKHT-KZRISWILSA-N -HMDB0055415 924.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 LNYZAFAGHAFCHN-TUJQORBGSA-N -HMDB0055416 866.772726384 TG(18:4(6Z,9Z,12Z,15Z)/18:1(11Z)/o-18:0) C57H102O5 IHUWPEXZDFNJHC-SSFJOSMMSA-N -HMDB0055418 900.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 KCXCVMHVAMVXKN-RSVDGXNBSA-N -HMDB0055421 924.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 ODSPHNHCZQVDMR-RRXWXJJESA-N 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TG(18:4(6Z,9Z,12Z,15Z)/24:1(15Z)/18:4(6Z,9Z,12Z,15Z)) C63H104O6 NSAPJHVXFFFJJZ-IEECSKRWSA-N -HMDB0055446 950.866626771 TG(18:4(6Z,9Z,12Z,15Z)/24:1(15Z)/o-18:0) C63H114O5 RHQBRHXLEMVAPU-OIVAJGPLSA-N -HMDB0055450 924.720690811 TG(18:4(6Z,9Z,12Z,15Z)/18:2(9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C61H96O6 GFYRVXIUUHCNOX-PYBIRZDYSA-N -HMDB0055461 924.720690811 TG(18:4(6Z,9Z,12Z,15Z)/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) C61H96O6 VFVJRYCSOQQDRY-DDUYTNIKSA-N -HMDB0055462 952.75199094 TG(18:4(6Z,9Z,12Z,15Z)/20:2n6/22:5(7Z,10Z,13Z,16Z,19Z)) C63H100O6 GYHBJVUQEUTNJK-DXLSKUAMSA-N -HMDB0055466 924.720690811 TG(18:4(6Z,9Z,12Z,15Z)/20:3n6/20:4(8Z,11Z,14Z,17Z)) C61H96O6 QOWBFANLOZBMRP-BGIUHIBNSA-N -HMDB0055478 954.767641004 TG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/20:4(8Z,11Z,14Z,17Z)) C63H102O6 PTSQXKFHEOEPFF-BWZJOCMQSA-N -HMDB0055479 952.75199094 TG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) C63H100O6 FCYZFOKGTFCMBJ-GZRWFLKJSA-N -HMDB0055480 980.783291069 TG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H104O6 WSUKABRGISKTKI-CYJBUPIJSA-N -HMDB0055481 978.767641004 TG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H102O6 TXXAAMLWYFWSKB-LCRQXKBFSA-N -HMDB0055486 976.75199094 TG(18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H100O6 ZJDPMLJZMVILST-VXOFYVADSA-N -HMDB0055487 974.736340876 TG(18:4(6Z,9Z,12Z,15Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H98O6 HUYCOKLLYZTFEE-POOOPPLSSA-N -HMDB0055492 974.736340876 TG(18:4(6Z,9Z,12Z,15Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H98O6 JBTCSEUULKOTDN-VKGWCSRVSA-N -HMDB0055518 886.741426256 TG(18:4(6Z,9Z,12Z,15Z)/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C59H98O5 DIZRZQIIMNNDRW-OCEZWEHYSA-N -HMDB0055522 974.736340876 TG(18:4(6Z,9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C65H98O6 KGMWBODWUGOVSS-APHFBTFESA-N -HMDB0055533 886.741426256 TG(18:4(6Z,9Z,12Z,15Z)/o-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) C59H98O5 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TG(20:4(8Z,11Z,14Z,17Z)/22:0/o-18:0) C63H116O5 SLYLFMOSDCVRJE-UPHNUPBLSA-N -HMDB0055575 838.741426256 TG(20:4(8Z,11Z,14Z,17Z)/14:1(9Z)/o-18:0) C55H98O5 FRZIUSLXTUICSQ-HTNVVQHESA-N -HMDB0055576 900.720690804 TG(20:4(8Z,11Z,14Z,17Z)/16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) C59H96O6 ZBFSNQAJGYUCEB-JREPOLGBSA-N -HMDB0055579 924.720690811 TG(20:4(8Z,11Z,14Z,17Z)/16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C61H96O6 SUUKHPGWXKPJHR-USVDPLRASA-N -HMDB0055580 866.772726384 TG(20:4(8Z,11Z,14Z,17Z)/16:1(9Z)/o-18:0) C57H102O5 VXMBUOMIVSCLTQ-IIAASTAYSA-N -HMDB0055583 954.767641004 TG(20:4(8Z,11Z,14Z,17Z)/18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 HPDGVKHFCTUXLJ-ZGXJXTGRSA-N -HMDB0055584 952.75199094 TG(20:4(8Z,11Z,14Z,17Z)/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C63H100O6 JZOMROZIKMUNRL-SYYWSRFDSA-N -HMDB0055585 894.804026513 TG(20:4(8Z,11Z,14Z,17Z)/18:1(11Z)/o-18:0) C59H106O5 YNSZYTDNGONQCW-UINOCOEESA-N -HMDB0055588 954.767641004 TG(20:4(8Z,11Z,14Z,17Z)/18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) C63H102O6 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BTKJUGSNYRWBGG-RBLKAGLASA-N -HMDB0055913 976.751990932 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H100O6 FMKKRMHWNRHGQT-JCGSDYFESA-N -HMDB0055918 942.804026513 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(5Z,8Z,11Z)/o-18:0) C63H106O5 FHTDYIDIOVTTCF-PYTKWOQPSA-N -HMDB0055928 944.819676578 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2n6/o-18:0) C63H108O5 GYVVNJNAXWYMSI-MUJLVZCHSA-N -HMDB0055930 942.804026513 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3n6/o-18:0) C63H106O5 HPSNFWYKNKZZRH-KDJKQSKKSA-N -HMDB0055932 940.788376449 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z)/o-18:0) C63H104O5 ZYZCTQBWUMGGIY-DQXAJJAXSA-N -HMDB0055938 966.804026513 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)/o-18:0) C65H106O5 BDGPXFOSOLYLHH-QXGZUXTBSA-N -HMDB0055944 940.788376449 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(8Z,11Z,14Z,17Z)/o-18:0) C63H104O5 ITTQJNRRFXILFF-JSBVHTTMSA-N -HMDB0055946 938.772726384 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)/o-18:0) C63H102O5 UQAQHCSDUNHUKS-TZZXVMCZSA-N -HMDB0055948 966.804026513 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)/o-18:0) C65H106O5 MEODBAFRLCEHNV-RTEQVISCSA-N -HMDB0055950 964.788376449 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0) C65H104O5 NBCFODXTSOUUIN-SRSBRRAPSA-N -HMDB0055951 964.788376438 TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/o-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) C65H104O5 SLNZHQMWTFFEGB-CQZSHLFASA-N -HMDB0055974 614.491025225 DG(14:0/0:0/22:5n6) C39H66O5 TUHWKCBRUXQIHQ-ADNFXOFXSA-N -HMDB0055979 614.491025225 DG(14:0/0:0/22:5n3) C39H66O5 YEUGSVVCGREBDT-BBSCOQMWSA-N -HMDB0055980 612.475375161 DG(14:0/0:0/22:6n3) C39H64O5 DNGFLPFNXOMGJW-CEKAUKHESA-N -HMDB0056033 614.491025225 DG(16:0/0:0/20:5n3) C39H66O5 OSXMEYNKEVXBGM-NNKYWXBCSA-N -HMDB0056055 670.553625483 DG(18:0/0:0/22:5n6) C43H74O5 XIZKIPQKOHUAHX-NLGFXGKHSA-N -HMDB0056060 670.553625483 DG(18:0/0:0/22:5n3) C43H74O5 DRUQEDUMAQZVOU-WPCIJTTOSA-N -HMDB0056061 668.537975418 DG(18:0/0:0/22:6n3) C43H72O5 RRALAGZOUWRTFP-USQBYQOHSA-N -HMDB0056084 670.553625483 DG(20:0/0:0/20:5n3) C43H74O5 UFBCJKWLEUICAE-XHJGARTISA-N -HMDB0056148 614.491025225 DG(14:1n5/0:0/22:4n6) C39H66O5 YWYQODJQQTZXGP-XDZXJOEWSA-N -HMDB0056149 612.475375161 DG(14:1n5/0:0/22:5n6) C39H64O5 CDTXMUFCBIHNCK-NUUBBBAFSA-N -HMDB0056154 612.475375161 DG(14:1n5/0:0/22:5n3) C39H64O5 DSPKXVYJORTNRJ-AQUVOALMSA-N -HMDB0056167 614.491025225 DG(16:1n7/0:0/20:4n6) C39H66O5 JWCNGONSUJKGDO-HKHOLRNYSA-N -HMDB0056173 614.491025225 DG(16:1n7/0:0/20:4n3) C39H66O5 RESRNMIXCOXYHQ-FXGFDOJOSA-N -HMDB0056174 612.475375161 DG(16:1n7/0:0/20:5n3) C39H64O5 XJJBSSJHWZLHHT-VXNPXAPHSA-N -HMDB0056189 670.553625483 DG(18:1n7/0:0/22:4n6) C43H74O5 IKSWSKJAXUGKHC-YKLMAKBOSA-N -HMDB0056190 668.537975418 DG(18:1n7/0:0/22:5n6) C43H72O5 RJUNCJKUOOBPGW-QIVCKLOOSA-N -HMDB0056192 614.491025225 DG(18:1n7/0:0/18:4n3) C39H66O5 FYYBTKGJGCSNCV-JRRRHNQSSA-N -HMDB0056195 668.537975418 DG(18:1n7/0:0/22:5n3) C43H72O5 BWPPXWXSNNMLOW-MOZLSNFLSA-N -HMDB0056208 670.553625483 DG(18:1n9/0:0/22:4n6) C43H74O5 QPKXQZITTOAAKY-UAGIJASUSA-N -HMDB0056209 668.537975418 DG(18:1n9/0:0/22:5n6) C43H72O5 GHJOXQFLZDFHBM-UKICFWOOSA-N -HMDB0056211 614.491025222 DG(18:1n9/0:0/18:4n3) C39H66O5 IAFKLCDFTGOUGB-YKVFHVBNSA-N -HMDB0056214 668.537975418 DG(18:1n9/0:0/22:5n3) C43H72O5 MARDKHBEDGKFMD-IGQXSGMTSA-N -HMDB0056224 670.553625483 DG(20:1n9/0:0/20:4n6) C43H74O5 KYTZSBQBUCWGRJ-NDSSCVKOSA-N -HMDB0056230 670.553625483 DG(20:1n9/0:0/20:4n3) C43H74O5 MGNMWMMQKHUXCT-GHHPGRLNSA-N -HMDB0056231 668.537975418 DG(20:1n9/0:0/20:5n3) C43H72O5 JADWQWJGAYXZKD-GJSVQJKPSA-N -HMDB0056234 668.537975414 DG(20:3n9/0:0/20:3n9) C43H72O5 GOLRHKZVCRTBFW-TYPXCCOQSA-N -HMDB0056239 670.553625483 DG(20:3n9/0:0/20:2n6) C43H74O5 IGVSZJYOSQMZTC-XASTUVSNSA-N -HMDB0056240 668.537975418 DG(20:3n9/0:0/20:3n6) C43H72O5 PPTFPPBZILRDOI-PWCDXBRGSA-N -HMDB0056262 670.553625483 DG(22:1n9/0:0/18:4n3) C43H74O5 QWBJFHUMPKVXOT-UQJNFHCUSA-N -HMDB0056283 628.50667529 DG(18:2n6/0:0/18:3n6) C40H68O5 DQSHOTZVAMTFFY-YKOUHSFPSA-N -HMDB0056288 682.553625483 DG(18:2n6/0:0/22:4n6) C44H74O5 RSFDYJRKLOLHJO-YWZUKEIHSA-N -HMDB0056290 628.50667529 DG(18:2n6/0:0/18:3n3) C40H68O5 VLJNBDVONLLDHB-LYDYFVHUSA-N -HMDB0056291 626.491025225 DG(18:2n6/0:0/18:4n3) C40H66O5 JODFYBIHEFCIFI-MHGYVTJFSA-N -HMDB0056296 612.475375158 DG(18:3n6/0:0/18:3n6) C39H64O5 LZSJCSQKHQTZID-HUYIQXHZSA-N -HMDB0056300 670.553625483 DG(18:3n6/0:0/22:2n6) C43H74O5 WZWSISJCYNBNPX-AFNSDXKHSA-N -HMDB0056303 612.475375161 DG(18:3n6/0:0/18:3n3) C39H64O5 UFKFDATWXJRMOS-UKPISMAMSA-N -HMDB0056310 670.553625483 DG(20:2n6/0:0/20:3n6) C43H74O5 IVASVZFPDOWZBQ-MXAZPZDMSA-N -HMDB0056311 668.537975418 DG(20:2n6/0:0/20:4n6) C43H72O5 ODIFDYMVTZMQLS-SZDMVCCJSA-N -HMDB0056317 668.537975418 DG(20:2n6/0:0/20:4n3) C43H72O5 ZLEJYIVDPRFANO-WUIAEINNSA-N -HMDB0056321 668.537975414 DG(20:3n6/0:0/20:3n6) C43H72O5 YTOCFNTUAXVUGF-HUYIQXHZSA-N -HMDB0056345 670.553625483 DG(22:2n6/0:0/18:3n3) C43H74O5 WGCCNBRJWHJBEZ-KUSRJDHNSA-N -HMDB0056346 668.537975418 DG(22:2n6/0:0/18:4n3) C43H72O5 GRJUVGUIQWBDLN-FCDTXGFCSA-N -HMDB0056366 612.475375158 DG(18:3n3/0:0/18:3n3) C39H64O5 NSOPGAYUGBZWHL-YTWBPVBXSA-N -HMDB0059655 148.037173366 2-Hydroxyglutarate C5H8O5 HWXBTNAVRSUOJR-UHFFFAOYSA-N -HMDB0059777 286.214409448 "2,2,4-Trimethyl-1,3-pentadienol diisobutyrate" C16H30O4 OMVSWZDEEGIJJI-UHFFFAOYSA-N -HMDB0059805 133.052763851 5-Hydroxyindole C8H7NO LMIQERWZRIFWNZ-UHFFFAOYSA-N -HMDB0059810 106.07825032 m-Xylene C8H10 IVSZLXZYQVIEFR-UHFFFAOYSA-N -HMDB0059819 120.093900384 o-Ethyltoluene C9H12 HYFLWBNQFMXCPA-UHFFFAOYSA-N -HMDB0059830 240.281701152 Heptadecane C17H36 NDJKXXJCMXVBJW-UHFFFAOYSA-N -HMDB0059832 134.109550448 4-Ethyl-o-xylene C10H14 SBUYFICWQNHBCM-UHFFFAOYSA-N -HMDB0059835 142.135765198 Nonanal C9H18O GYHFUZHODSMOHU-UHFFFAOYSA-N -HMDB0059837 118.07825032 Indane C9H10 PQNFLJBBNBOBRQ-UHFFFAOYSA-N -HMDB0059839 136.125200515 Camphene C10H16 CRPUJAZIXJMDBK-UHFFFAOYSA-N -HMDB0059843 88.034670946 (1E)-1-(methylthio)prop-1-ene C4H8S YJOGCMRDEUBRJD-ONEGZZNKSA-N -HMDB0059847 132.057514878 2-Methylcumarone C9H8O GBGPVUAOTCNZPT-UHFFFAOYSA-N -HMDB0059848 120.093900384 m-Ethyl_toluene C9H12 ZLCSFXXPPANWQY-UHFFFAOYSA-N -HMDB0059851 106.07825032 o-Xylene C8H10 CTQNGGLPUBDAKN-UHFFFAOYSA-N -HMDB0059873 122.073164942 3-Ethylphenol C8H10O HMNKTRSOROOSPP-UHFFFAOYSA-N -HMDB0059877 120.093900384 Propylbenzene C9H12 ODLMAHJVESYWTB-UHFFFAOYSA-N -HMDB0059878 202.172150708 alpha-Curcumene C15H22 VMYXUZSZMNBRCN-UHFFFAOYSA-N -HMDB0059886 212.250401024 Pentadecane C15H32 YCOZIPAWZNQLMR-UHFFFAOYSA-N -HMDB0059889 102.10446507 Isohexanol C6H14O PCWGTDULNUVNBN-UHFFFAOYSA-N -HMDB0059899 118.07825032 alpha-Methylstyrene C9H10 XYLMUPLGERFSHI-UHFFFAOYSA-N -HMDB0059901 120.093900384 Hemimellitene C9H12 FYGHSUNMUKGBRK-UHFFFAOYSA-N -HMDB0059905 106.07825032 Ethylbenzene C8H10 YNQLUTRBYVCPMQ-UHFFFAOYSA-N -HMDB0059907 198.23475096 Tetradecane C14H30 BGHCVCJVXZWKCC-UHFFFAOYSA-N -HMDB0059909 282.328651344 Eicosane C20H42 CBFCDTFDPHXCNY-UHFFFAOYSA-N -HMDB0059911 231.020143093 "Paracetamol sulfate" C8H9NO5S IGTYILLPRJOVFY-UHFFFAOYSA-N -HMDB0059924 106.07825032 p-Xylene C8H10 URLKBWYHVLBVBO-UHFFFAOYSA-N -HMDB0060015 173.99867937 "Phenol sulphate" C6H6O4S CTYRPMDGLDAWRQ-UHFFFAOYSA-N -HMDB0060038 268.240230268 "10Z-Heptadecenoic acid" C17H32O2 GDTXICBNEOEPAZ-FPLPWBNLSA-N -HMDB0060039 306.255880332 "11,14,17-Eicosatrienoic acid" C20H34O2 AHANXAKGNAKFSK-PDBXOOCHSA-N -HMDB0060256 166.047738052 L-Xylonate C5H10O6 QXKAIJAYHKCRRA-NUNKFHFFSA-N -HMDB0060282 324.035866536 3'-UMP C9H13N2O9P FOGRQMPFHUHIGU-XVFCMESISA-N -HMDB0060289 161.047678473 Quinoline-4,8-diol C9H7NO2 PYELIMVFIITPER-UHFFFAOYSA-N -HMDB0060472 296.132491381 Didemethylcitalopram C18H17FN2O RKUKMUWCRLRPEJ-UHFFFAOYSA-N -HMDB0060493 293.111066589 N-Acetylmuramate C11H19NO8 MNLRQHMNZILYPY-MKFCKLDKSA-N -HMDB0060564 236.104859 Carboxy-ibuprofen C13H16O4 DIVLBIVDYADZPL-UHFFFAOYSA-N -HMDB0060565 222.125594442 1-Hydroxyibuprofen C13H18O3 RMOQYHYFRKTDRI-UHFFFAOYSA-N -HMDB0060602 195.053157781 "N-acetyl-5-aminosalicylic acid" C9H9NO4 GEFDRROBUCULOD-UHFFFAOYSA-N -HMDB0060656 206.141913208 Monoethylglycinexylidide C12H18N2O WRMRXPASUROZGT-UHFFFAOYSA-N -HMDB0060920 222.125594442 2-Hydroxyibuprofen C13H18O3 UJHKVYPPCJBOSG-UHFFFAOYSA-N -HMDB0060921 222.125594442 3-Hydroxyibuprofen C13H18O3 HFAIHLSDLUYLQA-UHFFFAOYSA-N -HMDB0061014 574.247915067 <i>para</i>-hydroxyatorvastatin C33H35FN2O6 SOZOATLLFFVAPM-UHFFFAOYSA-N -HMDB0061015 574.247915067 <i>ortho</i>-hydroxyatorvastatin C33H35FN2O6 CZBPKFICAYVHHM-UHFFFAOYSA-N -HMDB0061112 240.099773622 "3-Carboxy-4-methyl-5-propyl-2-furanpropionic acid" C12H16O5 WMCQWXZMVIETAO-UHFFFAOYSA-N -HMDB0061115 246.13682783 Lenticin C14H18N2O2 AOHCBEAZXHZMOR-ZDUSSCGKSA-N -HMDB0061384 184.121177766 N-(3-acetamidopropyl)pyrrolidin-2-one C9H16N2O2 OAUYENAPBFTAQT-UHFFFAOYSA-N -HMDB0061642 415.329773555 "3-hydroxyhexadecanoyl carnitine" C23H45NO5 XKAZIAFZAQAHHG-UHFFFAOYSA-N -HMDB0061652 132.07864425 "3-hydroxyhexanoic acid" C6H12O3 HPMGFDVTYHWBAG-UHFFFAOYSA-N -HMDB0061684 173.105193351 N-Acetylisoleucine C8H15NO3 JDTWZSUNGHMMJM-UHFFFAOYSA-N -HMDB0061696 600.327463672 1-Stearoylglycerophosphoinositol C27H53O12P MXAFDFDAIFZFET-CZDOQZASSA-N -HMDB0061697 512.311419678 1-Stearoylglycerophosphoglycerol C24H49O9P HFJVKBVEKQHVTO-UHFFFAOYSA-N -HMDB0061701 522.355964567 2-Oleoylglycerophosphocholine C26H53NO7P SULIDBRAXVDKBU-SEYXRHQNSA-O -HMDB0061702 496.340314503 2-Palmitoylglycerophosphocholine C24H51NO7P NEGQHKSYEYVFTD-UHFFFAOYSA-O -HMDB0061703 512.311419678 2-Stearoylglycerophosphoglycerol C24H49O9P ZYKIFISVQNGKFE-UHFFFAOYSA-N -HMDB0061705 143.058243159 "6-Oxopiperidine-2-carboxylic acid" C6H9NO3 FZXCPFJMYOQZCA-UHFFFAOYSA-N -HMDB0061707 242.224580204 "13-Methylmyristic acid" C15H30O2 ZOCYQVNGROEVLU-UHFFFAOYSA-N -HMDB0061708 296.23514489 13-HODE C18H32O3 HNICUWMFWZBIFP-IRQZEAMPSA-N -HMDB0061709 270.255880335 15-Methylpalmitate C17H34O2 IIUXHTGBZYEGHI-UHFFFAOYSA-N -HMDB0061710 298.28718046 17-Methylstearate C19H38O2 YETXGSGCWODRAA-UHFFFAOYSA-N -HMDB0061711 111.99254516 Methylphosphate CH5O4P CAAULPUQFIIOTL-UHFFFAOYSA-N -HMDB0061712 702.567574782 "Palmitoyl sphingomyelin" C39H79N2O6P RWKUXQNLWDTSLO-GWQJGLRPSA-N -HMDB0061714 336.302830524 "Docosadienoate (22:2n6)" C22H40O2 HVGRZDASOHMCSK-UHFFFAOYSA-N -HMDB0061715 161.068807845 "Glutamate, gamma-methyl ester" C6H11NO4 ZGEYCCHDTIDZAE-UHFFFAOYSA-N -HMDB0061717 261.121237336 Succinylcarnitine C11H19NO6 HAEVNYBCYZZDFL-MRVPVSSYSA-N -HMDB0061795 138.140850576 (S)-3,7-Dimethyl-1,6-octadiene C10H18 FUDNBFMOXDUIIE-SNVBAGLBSA-N -HMDB0061822 282.167853186 "Hexaethylene glycol" C12H26O7 IIRDTKBZINWQAW-UHFFFAOYSA-N -HMDB0061835 326.194067936 "Heptaethylene glycol" C14H30O8 XPJRQAIZZQMSCM-UHFFFAOYSA-N -HMDB0061851 204.187800773 alpha-Copaene C15H24 VLXDPFLIRFYIME-XIQJJJERSA-N -HMDB0061864 280.24023027 "Dihomolinoleic acid" C18H32O2 GKJZMAHZJGSBKD-JPDBVBESSA-N -HMDB0061869 41.026549101 Acetonitrile C2H3N WEVYAHXRMPXWCK-UHFFFAOYSA-N -HMDB0061871 90.05032101 1-(Methylthio)-propane C4H10S ZOASGOXWEHUTKZ-UHFFFAOYSA-N -HMDB0061875 84.068748266 2-(Dimethylamino)acetonitrile C4H8N2 PLXBWEPPAAQASG-UHFFFAOYSA-N -HMDB0061883 116.083729628 "Caproate (6:0)" C6H12O2 FUZZWVXGSFPDMH-UHFFFAOYSA-N -HMDB0061884 86.109550448 2-Methylpentane C6H14 AFABGHUZZDYHJO-UHFFFAOYSA-N -HMDB0061885 86.109550448 3-Methylpentane C6H14 PFEOZHBOMNWTJB-UHFFFAOYSA-N -HMDB0061890 186.064056818 Pyroglutamylglycine C7H10N2O4 MGEFGYONNZYSPY-UHFFFAOYSA-N -HMDB0061892 98.109550448 2-Heptene C7H14 OTTZHAVKAVGASB-HYXAFXHYSA-N -HMDB0061896 114.10446507 2-Methyl-3-hexanone C7H14O HIGGFWFRAWSMBR-UHFFFAOYSA-N -HMDB0061898 124.088815006 Methyl-1-cyclopenten-1-yl)-ethanone C8H12O HDURLXYBKGWETC-UHFFFAOYSA-N -HMDB0061903 112.125200512 (Z)-2-Octene C8H16 ILPBINAXDRFYPL-HYXAFXHYSA-N -HMDB0061904 112.125200512 (E)-2-Octene C8H16 ILPBINAXDRFYPL-UHFFFAOYSA-N -HMDB0061906 112.125200512 (E)-3-Octene C8H16 YCTDZYMMFQCTEO-FNORWQNLSA-N -HMDB0061907 112.125200512 3-Methyleneheptane C8H16 XTVRLCUJHGUXCP-UHFFFAOYSA-N -HMDB0061914 160.109944375 8-Hydroxyoctanoate C8H16O3 KDMSVYIHKLZKET-UHFFFAOYSA-N -HMDB0061916 134.036779436 Phenylglyoxal C8H6O2 OJUGVDODNPJEEC-UHFFFAOYSA-N -HMDB0061918 133.052763851 1,3-Dihydro-(2H)-indol-2-one C8H7NO JYGFTBXVXVMTGB-UHFFFAOYSA-N -HMDB0061923 190.172150704 1,3-Di-tert-butylbenzene C14H22 ILNDSSCEZZFNGE-UHFFFAOYSA-N -HMDB0061927 118.062994186 "5-Hydroxypentanoic acid" C5H10O3 PHOJOSOUIAQEDH-UHFFFAOYSA-N -HMDB0062119 186.161979948 "Hexyl valerate" C11H22O2 YERFHJZYNMRVLO-UHFFFAOYSA-N -HMDB0062121 196.073558872 "Hydroferulic acid" C10H12O4 BOLQJTPHPSDZHR-UHFFFAOYSA-N -HMDB0062251 89.047678473 "(alpha-D-mannosyl)7-beta-D-mannosyl-diacetylchitobiosyl-L-asparagine, isoform A (protein)" C3H7NO2 QNAYBMKLOCPYGJ-UHFFFAOYSA-N -HMDB0062436 310.287180464 "9Z-Eicosenoic acid" C20H38O2 LQJBNNIYVWPHFW-QXMHVHEDSA-N -HMDB0062511 144.115029756 "octanoate radical" C8H16O2 WWZKQHOCKIZLMA-UHFFFAOYSA-N -HMDB0062541 496.339766404 1-palmitoylglycerophosphocholine C24H51NO7P ASWBNKHCZGQVJV-UHFFFAOYSA-O -HMDB0062544 384.160659796 "16a-hydroxy DHEA 3-sulfate" C19H28O6S ALBNSVAJDFJRKQ-UHFFFAOYSA-N -HMDB0062547 247.015058188 "2-Hydroxyacetaminophen sulfate" C8H9NO6S HRLQZTOIKWEZBN-UHFFFAOYSA-N -HMDB0062549 300.266445019 "2-Hydroxystearic acid" C18H36O3 KIHBGTRZFAVZRV-UHFFFAOYSA-N -HMDB0062550 261.030708252 "2-Methoxyacetaminophen sulfate" C9H11NO6S NZKKXAGORRATJB-UHFFFAOYSA-N -HMDB0062551 202.029979976 4-ethylphenylsulfate C8H10O4S DWZGLEPNCRFCEP-UHFFFAOYSA-N -HMDB0062555 261.157622845 "hydroxyisovaleroyl carnitine" C12H23NO5 DHRNMNHPSWBJEN-UHFFFAOYSA-N -HMDB0062557 161.068807845 N-Acetylthreonine C6H11NO4 PEDXUVCGOLSNLQ-WUJLRWPWSA-N -HMDB0062558 128.058577506 Pyroglutamine C5H8N2O2 NPWMTBZSRRLQNJ-UHFFFAOYSA-N -HMDB0062559 730.598875399 "stearoyl sphingomyelin" C41H83N2O6P LKQLRGMMMAHREN-YJFXYUILSA-N -HMDB0062562 138.042927441 Trans-urocanate C6H6N2O2 LOIYMIARKYCTBW-UHFFFAOYSA-N -HMDB0062579 328.24023027 (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate C22H32O2 MBMBGCFOFBJSGT-UHFFFAOYSA-N -HMDB0062583 179.058243159 N-benzoylglycinate C9H9NO3 QIAFMBKCNZACKA-UHFFFAOYSA-N -HMDB0062620 136.037173366 "L-threonic Acid" C4H8O5 JPIJQSOTBSSVTP-STHAYSLISA-N -HMDB0062651 521.348140016 2-oleoyl-sn-glycero-3-phosphocholine C26H52NO7P SULIDBRAXVDKBU-PTGWMXDISA-N -HMDB0062656 279.256214687 Linoleamide C18H33NO SFIHQZFZMWZOJV-HZJYTTRNSA-N -HMDB0062657 370.18139524 "Epiandrosterone sulfate" C19H30O5S ZMITXKRGXGRMKS-LUJOEAJASA-N -HMDB0062660 161.068807845 "N-methyl-L-glutamic Acid" C6H11NO4 XLBVNMSMFQMKEY-BYPYZUCNSA-N -HMDB0062665 704.583225334 N-hexadecanoylsphinganine-1-phosphocholine C39H81N2O6P QHZIGNLCLJPLCU-QPPIDDCLSA-N -HMDB0062690 785.593455181 1,2-dioleoyl-sn-glycero-3-phosphocholine C44H84NO8P SNKAWJBJQDLSFF-NVKMUCNASA-N -HMDB0062720 230.061280105 "Thymol Sulfate" C10H14O4S NODSEPOUFZPJEQ-UHFFFAOYSA-N -HMDB0062731 384.145992314 Dodecamethylpentasiloxane C12H36O4Si5 FBZANXDWQAVSTQ-UHFFFAOYSA-N -HMDB0062812 132.053492132 N-carbamoyl-beta-alaninate C4H8N2O3 JSJWCHRYRHKBBW-UHFFFAOYSA-N -HMDB0094646 249.136493476 "2-Pentanamido-3-phenylpropanoic acid" C14H19NO3 YXQLJEQFZUMUPB-UHFFFAOYSA-N -HMDB0094648 357.262756619 Leu-Leu-Leu C18H35N3O4 DNDWZFHLZVYOGF-UHFFFAOYSA-N -HMDB0094649 145.110278727 2-Aminoheptanoate C7H15NO2 RDFMDVXONNIGBC-UHFFFAOYSA-N -HMDB0094650 237.05719778 "5alpha-pregnan-3beta,20alpha-diol disulfate" C10H11N3O2S AVQNPDXTQNUWMO-UHFFFAOYSA-N -HMDB0094651 228.111007003 Pyroglutamylvaline C10H16N2O4 DTSWLLBBGHRXQH-XPUUQOCRSA-N -HMDB0094652 140.156500644 "2-Octene, 3,7-dimethyl-, (Z)-" C10H20 ADGIRGGMVLTMJM-BJMVGYQFSA-N -HMDB0094653 256.106330962 "Pyrimidine, 2,4- bis[(trimethylsilyl)oxy]-" C10H20N2O2Si2 FSBNTQRWSOTNEW-UHFFFAOYSA-N -HMDB0094654 172.146329884 "1-Methylethyl heptanoic acid" C10H20O2 RMQUEHVMCJEEOS-UHFFFAOYSA-N -HMDB0094656 188.141244504 2-Hydroxydecanoate C10H20O3 GHPVDCPCKSNJDR-UHFFFAOYSA-N -HMDB0094657 191.058243159 2-Oxindole-3-acetate C10H9NO3 ILGMGHZPXRDCCS-UHFFFAOYSA-N -HMDB0094658 198.107836374 "1-[2-Methyl-3-(methylthio) allyl]cyclohex-2-enol" C11H18OS IFXHKNKBGMLXEH-MDZDMXLPSA-N -HMDB0094659 186.161979948 "1,1-Dimethylethyl heptanoic acid" C11H22O2 WLUUTGIJNRNHRF-UHFFFAOYSA-N -HMDB0094660 222.089208936 "Diethyl phthalic acid" C12H14O4 FLKPEMZONWLCSK-UHFFFAOYSA-N -HMDB0094661 176.120115135 1-Phenyl-2-hexanone C12H16O DYQAZJQDLPPHNB-UHFFFAOYSA-N -HMDB0094664 254.115833018 "1,2-Benzenediol bis(trimethylsilyl) ether" C12H22O2Si2 GEHYZCCVQVOFAF-UHFFFAOYSA-N -HMDB0094665 168.187800773 2,2,4,6,6-Pentamethyl-3-heptene C12H24 NBUMCEJRJRRLCA-CSKARUKUSA-N -HMDB0094666 168.187800773 "Nonyl cyclopropane" C12H24 DTLFSMAJSOYMCO-UHFFFAOYSA-N -HMDB0094667 168.187800773 "3-Methyl-2-undecene (Z)" C12H24 LKWKOLGLWOJMQP-XGICHPGQSA-N -HMDB0094668 230.170206612 "Trimethylsilyl nonanoic acid" C12H26O2Si ISTGUORKGWWKMI-UHFFFAOYSA-N -HMDB0094669 250.12050906 "Methyl neopentyl phthalic acid" C14H18O4 LJBHDCZOMUACDL-UHFFFAOYSA-N -HMDB0094670 190.172150708 1,4-Bis-(1,1-dimethylethyl)-benzene C14H22 OOWNNCMFKFBNOF-UHFFFAOYSA-N -HMDB0094671 226.193280077 "Heptyl cyclohexane carboxylic acid" C14H26O2 TXWXLLMVRVKQSO-UHFFFAOYSA-N -HMDB0094672 244.203844762 3-Hydroxymyristate C14H28O3 ATRNZOYKSNPPBF-UHFFFAOYSA-N -HMDB0094673 260.152477892 Cyclo(Leu-Phe) C15H20N2O2 QPDMOMIYLJMOQJ-STQMWFEESA-N -HMDB0094674 218.167065328 "N-Octyl phenyl ketone" C15H22O PFUPABFCHVRLLY-UHFFFAOYSA-N -HMDB0094675 309.158032183 "N,O-Bis- (trimethylsilyl)phenylalanine" C15H27NO2Si2 DWNFNBPPSFIIBG-UHFFFAOYSA-N -HMDB0094676 315.215806426 Val-Val-Val C15H29N3O4 LSLXWOCIIFUZCQ-UHFFFAOYSA-N -HMDB0094677 272.217156805 "Dodecanoic acid, trimethylsilyl ester" C15H32O2Si RHDZBWSXEZTMPK-UHFFFAOYSA-N -HMDB0094680 370.220282686 "Octaethylene glycol" C16H34O9 GLZWNFNQMJAZGY-UHFFFAOYSA-N -HMDB0094681 314.264106999 "Trimethylsilyl n-pentadecanoic acid" C18H38O2Si SHDTWSQDHLKGEO-UHFFFAOYSA-N -HMDB0094682 452.153860338 "5alpha-Androstan-3alpha,17beta-diol disulfate" C19H32O8S2 JHFAETDERBWUOO-KHOSGYARSA-N -HMDB0094683 342.295407127 "Trimethylsilyl heptadecanoic acid" C20H42O2Si KCEZRIREPDDPDI-UHFFFAOYSA-N -HMDB0094684 356.292659768 Monooleoylglycerol C21H40O4 RZRNAYUHWVFMIP-KTKRTIGZSA-N -HMDB0094685 346.287180464 "Hexadecyl Benzoic acid" C23H38O2 RAMRROOXFMYSNA-UHFFFAOYSA-N -HMDB0094686 384.342357321 "Eicosanoic acid, trimethylsilyl ester" C23H48O2Si AYSGFBVOWSXJCN-UHFFFAOYSA-N -HMDB0094687 425.350508997 Octadecenoylcarnitine C25H47NO4 YIGBMCKQXUEBKC-UHFFFAOYSA-N -HMDB0094688 524.371615113 1-Stearoylglycerophosphocholine C26H55NO7P ARQYPVZFUYHQFR-RUZDIDTESA-N -HMDB0094690 88.070826921 Tetramethylsilane C4H12Si CZDYPVPMEAXLPK-UHFFFAOYSA-N -HMDB0094691 84.021129369 "Furanone A" C4H4O2 RHDGNLCLDBVESU-UHFFFAOYSA-N -HMDB0094692 103.063328537 N-Methylalanine C4H9NO2 GDFAOVXKHJXLEI-VKHMYHEASA-N -HMDB0094693 103.063328537 3-Aminobutyrate C4H9NO2 OQEBBZSWEGYTPG-UHFFFAOYSA-N -HMDB0094694 150.05282343 beta-Arabinose C5H10O5 HMFHBZSHGGEWLO-KLVWXMOXSA-N -HMDB0094696 129.078978601 "N-Methyl proline" C6H11NO2 CWLQUGTUXBXTLF-YFKPBYRVSA-N -HMDB0094698 145.073893218 N-Propionylalanine C6H11NO3 INPGLFHHFHOGRM-BYPYZUCNSA-N -HMDB0094699 161.087205262 "Trimethylsilyl l-Alanine" C6H15NO2Si MNHNHHIHUYPXHP-YFKPBYRVSA-N -HMDB0094701 157.073893223 N-Acetylproline C7H11NO3 GNMSLDIYJOSUSW-LURJTMIESA-N -HMDB0094703 189.082119882 "Propanoic acid, 2-(methoxyimino)-, trimethylsilyl ester" C7H15NO3Si RDATZQIINHXKAG-SOFGYWHQSA-N -HMDB0094704 205.077264521 N-Propionylmethionine C8H15NO3S RBAAEQRITQHPJM-LURJTMIESA-N -HMDB0094705 112.125200515 6-Methyl-1-heptene C8H16 DFVOXRAAHOJJBN-UHFFFAOYSA-N -HMDB0094707 130.1357652 2-Propyl-1-pentanol C8H18O LASHFHLFDRTERB-UHFFFAOYSA-N -HMDB0094708 194.115423686 "Tetraethylene glycol" C8H18O5 UWHCKJMYHZGTIT-UHFFFAOYSA-N -HMDB0094710 246.019809216 "3-[3-(Sulfooxy)phenyl]propanoic acid" C9H10O6S IQWLPDPKVFZEOK-UHFFFAOYSA-N -HMDB0240219 282.255880332 "cis-Vaccenic acid" C18H34O2 UWHZIFQPPBDJPM-FPLPWBNLSA-N -HMDB0240252 371.085245751 "Salicyluric beta-D-glucuronide" C15H17NO10 OEPADIDIUZTYOX-QKZHPOIUSA-N -HMDB0240253 167.025228948 N-Acetyltaurine C4H9NO4S CXJAAWRLVGAKDV-UHFFFAOYSA-N