Mercurial > repos > fgiacomoni > hmdb_ms_search
changeset 0:9583f9772198 draft
Init and uploaded
author | fgiacomoni |
---|---|
date | Thu, 28 Jan 2016 10:52:26 -0500 |
parents | |
children | 6d0a0f8f672a |
files | hmdb/README.txt hmdb/conf_hmdb.cfg hmdb/hmdb.tmpl hmdb/lib/conf.pm hmdb/lib/csv.pm hmdb/lib/hmdb.pm hmdb/static/images/hmdb.png hmdb/t/hmdb_managerTest.pl hmdb/t/lib/hmdbTest.pm hmdb/test_data/.DS_Store hmdb/test_data/._.DS_Store hmdb/test_data/input_test01_fake-mzrt-input-with-id.tsv hmdb/test_data/input_test02_mzrt-input-with-id.tsv hmdb/test_data/out_test01.csv hmdb/test_data/out_test01.html hmdb/test_data/out_test01.tsv hmdb/test_data/out_test02.csv hmdb/test_data/out_test02.html hmdb/test_data/out_test02.tsv hmdb/test_data/out_test03.csv hmdb/test_data/out_test03.html hmdb/test_data/out_test03.tsv hmdb/wsdl_hmdb.pl hmdb/wsdl_hmdb.xml |
diffstat | 24 files changed, 4533 insertions(+), 0 deletions(-) [+] |
line wrap: on
line diff
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/README.txt Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,65 @@ +## ****** HMDB environnemnt : ****** ## +# version January 2016 M Landi / F Giacomoni - INRA - METABOHUB - workflow4metabolomics.org core team + +## --- PERL compilator / libraries : --- ## +$ perl -v +This is perl, v5.10.1 (*) built for x86_64-linux-thread-multi + +# libs CORE PERL : +use strict ; +use warnings ; +use Carp qw (cluck croak carp) ; +use Exporter ; +use Data::Dumper ; +use Getopt::Long ; +use FindBin ; +use Encode; + +# libs CPAN PERL : +$ perl -e 'use Text::CSV' +$ perl -e 'use LWP::Simple' +$ perl -e 'use URI::URL' +$ perl -e 'use SOAP::Lite' +$ perl -e 'use HTML::Template' +$ sudo perl -MCPAN -e shell +cpan> install Text::CSV +cpan> install LWP::Simple +cpan> install URI::URL +cpan> install SOAP::Lite +cpan> install HTML::Template + +# libs pfem PERL : this lib were included in lib dir. +use conf::conf qw( :ALL ) ; +use formats::csv qw( :ALL ) ; +-- + +## --- R bin and Packages : --- ## +No interaction with R +-- + +## --- Binary dependencies --- ## +No interaction with binary - use only HMDB post method (http://www.hmdb.ca/spectra/ms/search?) +-- + +## --- Config : --- ## +JS and CSS (used in HTML output format) are now hosted on cdn.rawgit.com server - no local config needed + + +PS :If Galaxy can't find the file "hmdb.tmpl", perform this command line : perl -pi -e 's/\r//g' conf_hmdb.cfg +-- + +## --- XML HELP PART --- ## +one image : +hmdb.png +-- + +## --- DATASETS OR TUTORIAL --- ## +Please find help on W4M : +-- + +## --- ??? COMMENTS ??? --- ## +If Galaxy can't find the file "hmdb.tmpl", perform this command line : " perl -pi -e 's/\r//g' " on the conf file "conf_hmdb.cfg". + +To use fully functionalities of HTML output format file : + - check that sanitize_all_html option in universe_wsgi.ini file is uncomment and set to FALSE. +-- \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/conf_hmdb.cfg Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,14 @@ +## Conf file for wsdl_hmdb.pl script +# +## Version -- edited by F.Giacomoni +VERSION=2015-06-08 +# +## ARGVT +# Hmdb limits per job (max is 149) +HMDB_LIMITS=50 +## Galaxy url for HTML JS and CSS path +JS_GALAXY_PATH=https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/scripts +CSS_GALAXY_PATH=https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/style +# +## HTML OUTPUT : +HTML_ENTRIES_PER_PAGE=4
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/hmdb.tmpl Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1 @@ +<?xml version="1.0" encoding="UTF-8" ?><!DOCTYPE html><html lang="en"><head><meta charset="utf-8"><meta name="viewport" content="width=device-width, initial-scale=1.0"><meta name="description" content=""><meta name="author" content="INRA de Clermont-Ferrand"><title>Galaxy HMDB queries - All results</title><link rel="stylesheet" type="text/css" href="css.php" media="all"><link rel="stylesheet" type="text/css" href="<TMPL_VAR NAME=CSS_GALAXY_PATH>/simplePagination.css"/><!-- JavaScript --><script src="https://ajax.googleapis.com/ajax/libs/jquery/1.7.2/jquery.min.js"></script><script src="<TMPL_VAR NAME=JS_GALAXY_PATH>/jquery.simplePagination.js"></script><style type="text/css">body {padding-top: 70px}div.lm-table-warning { font-size: 1.4em; font-weight: bold; padding-right: 25px; color: #21536a; margin-left: 3px;}tr.green td {background-color: #eaf2d3; color: black;}tr.blank td {background-color: #9999CC; color: black;}table {font-family:'Trebuchet MS',Arial,Helvetica,sans-serif;width:100%;border-collapse:collapse;}table.detail, table.detail tr.parent, table.detail td, table.detail th, table.detail tr.category {border-collapse:collapse;border:1px solid #98bf21;}table.detail th {font-size: 1.2em;text-align: center;padding-top: 5px;padding-bottom: 10px;background-color: #a7c942;color: #ffffff;}td.ca {text-align:center;}footer { margin: 50px 0;}</style><script>function test(pageNumber){ var page="#page-id-"+pageNumber; $('.select').hide() ; $(page).show()}</script></head><body><div class="container"><div class="lm-table-warning">Results of HMDB queries - <TMPL_VAR NAME=CONDITIONS></div><div id="detail_table_source" style="display:none"></div><p><div id="choose"></div><p><div id="ms_search_0" class="ms-search-table"></div><!-- HeadRows--><table id="detail_table" class="detail"><col style="width:30px;"><!-- Ids (m/z)--><col style="width:30px;"><!-- Mass (m/z)--><col style="width:30px;"><!-- Compound--><col style="width:120px;"><!-- name--><col style="width:40px;"><!-- adduct--><col style="width:50px;"><!-- adduct type--><col style="width:60px;"><!-- adduct mw--><col style="width:60px;"><!-- cpd mw--><col style="width:50px;"><!-- delta--><thead><th>ID from input</th><th>Mass (m/z)</th><th>Compound_ID</th><th>Formula</th><th>Compound MW (Da)</th><th>Adduct</th><th>Adduct_Type</th><th>Adduct MW (Da)</th><th>Delta</th></thead><TMPL_LOOP NAME=PAGES><tbody class="select" id="page-id-<TMPL_VAR NAME=PAGE_NB>"><TMPL_LOOP NAME=MASSES><tr class="<TMPL_VAR NAME=MZ_COLOR>"><td class="ca" ><TMPL_VAR NAME=MASSES_ID_QUERY></td><td id="<TMPL_VAR NAME=MASSES_NB>" class="ca" ><TMPL_VAR NAME=MASSES_MZ_QUERY></td><td class="ca" colspan="7"></td></tr><TMPL_LOOP NAME=ENTRIES><tr class="<TMPL_VAR NAME=ENTRY_COLOR>"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/<TMPL_VAR NAME=ENTRY_ENTRY_ID2>" target="_blank" class="btn"><TMPL_VAR NAME=ENTRY_ENTRY_ID></a></td><td class="ca"><TMPL_VAR NAME=ENTRY_FORMULA></td><td class="ca"><TMPL_VAR NAME=ENTRY_CPD_MZ></td><td class="ca"><TMPL_VAR NAME=ENTRY_ADDUCT></td><td class="ca"><TMPL_VAR NAME=ENTRY_ADDUCT_TYPE></td><td class="ca"><TMPL_VAR NAME=ENTRY_ADDUCT_MZ></td><td class="ca"><TMPL_VAR NAME=ENTRY_DELTA></td></tr></TMPL_LOOP></TMPL_LOOP></tbody></TMPL_LOOP></table></div><div class="container"><hr><footer><div class="row"> <div class="col-lg-12"><p>Copyright © INRA, N Paulhe, F Giacomoni 2014 </p> </div> </div> </footer></div><script language="javascript">$(function() {$('#choose').pagination({items: <TMPL_VAR NAME=PAGES_NB>,itemsOnPage: 1,currentPage: 1,onInit: function () { test(1); },cssStyle: 'light-theme',onPageClick: function(pageNumber){test(pageNumber)}}).pagination('redraw');});</script></body></html> \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/lib/conf.pm Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,259 @@ +package lib::conf ; + +use strict; +use warnings ; +use Exporter ; +use Carp ; +use Data::Dumper ; + +use vars qw($VERSION @ISA @EXPORT %EXPORT_TAGS); + +our $VERSION = "1.0" ; +our @ISA = qw(Exporter) ; +our @EXPORT = qw( as_conf get_value_from_conf check_path_and_file ) ; +our %EXPORT_TAGS = ( ALL => [qw( as_conf get_value_from_conf )] ) ; + +=head1 NAME + +conf - A module for manage pfem conf file + +=head1 SYNOPSIS + + use conf ; + my $object = conf->new() ; + +=head1 DESCRIPTION + +This module does manage conf file (extract all or selected fields) + +=head1 METHODS + +Methods are : + +=head2 METHOD new + + ## Description : new + ## Input : $self + ## Ouput : bless $self ; + ## Usage : new() ; + +=cut +## START of SUB +sub new { + ## Variables + my $self={}; + bless($self) ; + return $self ; +} +### END of SUB + +=head2 METHOD as_conf + + ## Description : permet de cr�er l'object conf � partir d'un fichier de conf de type KEY=VALUE + ## Input : $file + ## Ouput : $oConf (a hash) + ## Usage : my ( $oConf ) = as_conf( $file ) ; + +=cut +## START of SUB +sub as_conf { + ## Retrieve Values + my $self = shift ; + my ( $file, $separator ) = @_ ; + +# if (!defined $separator) { $separator = ';' } ## set separator to ; + + if ( !defined $file ) { croak "Can't create object with an none defined file\n" ; } + + my %Conf = () ; ## Hash devant contenir l'ensemble des parametres locaux + + if (-e $file) { + open (CFG, "<$file") or die "Can't open $file\n" ; + while (<CFG>) { + chomp $_ ; + if ( $_ =~ /^#(.*)/) { next ; } + elsif ($_ =~/^(\w+?)=(.*)/) { ## ALPHANUMERIC OR UNDERSCORE ONLY FOR THE KEY AND ANYTHING ELSE FOR VALUE + + my ($key, $value) = ($1, $2) ; + + if (defined $separator) { + if ( $value=~/$separator/ ) { ## is a list to split + my @tmp = split(/$separator/ , $value) ; + $Conf{$key} = \@tmp ; + } + } + else { + $Conf{$key} = $value ; + } + } + } + close(CFG) ; + } + else { + croak "Can't create object with an none existing file\n" ; + } + + return ( \%Conf ) ; +} +## END of SUB + +=head2 METHOD as_conf_list + + ## Description : permet de charger une liste txt en array + ## Input : $file + ## Output : elements + ## Usage : my ( elements ) = as_conf_list( $conf_file ) ; + +=cut +## START of SUB +sub as_conf_list { + ## Retrieve Values + my $self = shift ; + my ( $file ) = @_ ; + + my @elements = () ; + if ( !defined $file ) { croak "Can't create object with an none defined file\n" ; } + + if (-e $file) { + open (CFG, "<$file") or die "Can't open $file\n" ; + while (<CFG>) { + chomp $_ ; + if ( $_ =~ /^#(.*)/) { next ; } + elsif ($_ =~/^(.*)/) { if (defined $1) { push (@elements, $1) ; } } + } + } + else { + croak "Can't create object with an none existing file\n" ; + } + return(\@elements) ; +} +## END of SUB + +=head2 METHOD get_value_from_conf + + ## Description : permet de retourner une valeur du hash de conf � partir d'une key + ## Input : $oConf, $Key + ## Ouput : $Value + ## Usage : my ( $Value ) = get_value_from_conf( $oConf, $Key ) ; + +=cut +## START of SUB +sub get_value_from_conf { + ## Retrieve Values + my $self = shift ; + my ( $oConf, $Key ) = @_ ; + + my $Value = undef ; + + if ( defined $oConf ) { + if ( defined $oConf->{$Key} ) { + $Value = $oConf->{$Key} ; + } + } + else { + croak "Can't manage value with undefined object\n" ; + } + return($Value) ; +} +## END of SUB + +=head2 METHOD get_value_from_conf + + ## Description : permet de retourner une valeur du hash de conf � partir d'une key + ## Input : $oConf, $Key + ## Ouput : $Value + ## Usage : my ( $Value ) = get_value_from_conf( $oConf, $Key ) ; + +=cut +## START of SUB +sub split_value_from_conf { + ## Retrieve Values + my $self = shift ; + my ( $oConf, $Key, $sep ) = @_ ; + + my $value = undef ; + my @values = () ; + + if ( defined $oConf ) { + if ( defined $oConf->{$Key} ) { + $value = $oConf->{$Key} ; + @values = split ( /$sep/, $value) ; + } + } + else { + croak "Can't manage value with undefined object\n" ; + } + return(\@values) ; +} +## END of SUB + + +=head2 METHOD check_path_and_file + + ## Description : permet de v�rifier les path et la pr�sence des exe d�crits dans le file conf. Bloque le script en cas de probleme + ## Input : $oConfs + ## Ouput : NA + ## Usage : &get_value_from_conf( $oConf ) ; + +=cut +## START of SUB +sub check_path_and_file { + + my $self = shift ; + my ( $oConfs ) = @_ ; + + foreach my $conf ( keys %{ $oConfs } ) { + if ( $conf =~ /^FILE/ ) { + if ( -e $oConfs->{$conf} ) { + if ( -s $oConfs->{$conf} ) { next ; } + else { carp "[Warning] : The size of file $oConfs->{$conf} is null\n" ; } + } + else { + carp "[Warning] : The file $oConfs->{$conf} doesn't exist\n" ; + } + } + elsif ( $conf =~ /^PATH/ ) { + if ( -d $oConfs->{$conf} ) { next ; } + else { carp "[Warning] : The dir $oConfs->{$conf} doesn't exist\n" ; } + } + else { next ; } + } + return ; +} +## END of SUB + +1 ; + + +__END__ + +=head1 SUPPORT + +You can find documentation for this module with the perldoc command. + + perldoc conf.pm + + +=head1 Exports + +=over 4 + +=item :ALL is as_conf get_value_from_conf + +=back + +=head1 AUTHOR + +Franck Giacomoni E<lt>franck.giacomoni@clermont.inra.frE<gt> + +=head1 LICENSE + +This program is free software; you can redistribute it and/or modify it under the same terms as Perl itself. + +=head1 VERSION + +version 1 : 10 / 02 / 2013 + +version 2 : ?? + +=cut \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/lib/csv.pm Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,239 @@ +package lib::csv ; + +use strict; +use warnings ; +use Exporter ; +use Carp ; + +use Text::CSV ; + +use Data::Dumper ; + +use vars qw($VERSION @ISA @EXPORT %EXPORT_TAGS); + +our $VERSION = "1.0"; +our @ISA = qw(Exporter); +our @EXPORT = qw( get_csv_object get_value_from_csv_multi_header ); +our %EXPORT_TAGS = ( ALL => [qw( get_csv_object get_value_from_csv_multi_header )] ); + +=head1 NAME + +My::Module - An example module + +=head1 SYNOPSIS + + use My::Module; + my $object = My::Module->new(); + print $object->as_string; + +=head1 DESCRIPTION + +This module does not really exist, it +was made for the sole purpose of +demonstrating how POD works. + +=head1 METHODS + +Methods are : + +=head2 METHOD new + + ## Description : new + ## Input : $self + ## Ouput : bless $self ; + ## Usage : new() ; + +=cut + +sub new { + ## Variables + my $self={}; + bless($self) ; + return $self ; +} +### END of SUB + +=head2 METHOD get_csv_object + + ## Description : builds a csv object and etablishes format + ## Input : $separator + ## Output : $csv + ## Usage : my ( $csv ) = get_csv_object( $separator ) ; + +=cut +## START of SUB +sub get_csv_object { + ## Retrieve Values + my $self = shift ; + my ( $separator ) = @_ ; + +# my $csv = Text::CSV->new({'sep_char' => "$separator"}); + my $csv = Text::CSV->new ( {'sep_char' => "$separator", binary => 1 } ) # should set binary attribute. + or die "Cannot use CSV: ".Text::CSV->error_diag (); + + return($csv) ; +} +## END of SUB + +=head2 METHOD get_value_from_csv_multi_header + + ## Description : extract a targeted column in a csv file + ## Input : $csv, $file, $column, $is_header, $nb_header + ## Output : $value + ## Usage : my ( $value ) = get_value_from_csv_multi_header( $csv, $file, $column, $is_header, $nb_header ) ; + +=cut +## START of SUB +sub get_value_from_csv_multi_header { + ## Retrieve Values + my $self = shift ; + my ( $csv, $file, $column, $is_header, $nb_header ) = @_ ; + + my @value = () ; + + ## Adapte the number of the colunm : (nb of column to position in array) + $column = $column - 1 ; + + open (CSV, "<", $file) or die $! ; + + my $line = 0 ; + + while (<CSV>) { + $line++ ; + chomp $_ ; + # file has a header + if ( defined $is_header and $is_header eq 'yes') { if ($line <= $nb_header) { next ; } } + # parsing the targeted column + if ( $csv->parse($_) ) { + my @columns = $csv->fields(); + push ( @value, $columns[$column] ) ; + } + else { + my $err = $csv->error_input; + die "Failed to parse line: $err"; + } + } + close CSV; + return(\@value) ; +} +## END of SUB + +=head2 METHOD parse_csv_object + + ## Description : parse_all csv object and return a array of rows + ## Input : $csv, $file + ## Output : $csv_matrix + ## Usage : my ( $csv_matrix ) = parse_csv_object( $csv, $file ) ; + +=cut +## START of SUB +sub parse_csv_object { + ## Retrieve Values + my $self = shift ; + my ( $csv, $file ) = @_ ; + + my @csv_matrix = () ; + + open my $fh, "<:encoding(utf8)", $$file or die "Can't open csv file $$file: $!"; + + while ( my $row = $csv->getline( $fh ) ) { + push @csv_matrix, $row; + } + $csv->eof or $csv->error_diag(); + close $fh; + + return(\@csv_matrix) ; +} +## END of SUB + +=head2 METHOD parse_allcsv_object + + ## Description : parse_all csv object and return a array of rows with or without header + ## Input : $csv, $file, $keep_header + ## Output : $csv_matrix + ## Usage : my ( $csv_matrix ) = parse_csv_object( $csv, $file, $keep_header ) ; + +=cut +## START of SUB +sub parse_allcsv_object { + ## Retrieve Values + my $self = shift ; + my ( $csv, $file, $keep_header ) = @_ ; + + my @csv_matrix = () ; + my $line = 1 ; + + open my $fh, "<:encoding(utf8)", $$file or die "Can't open csv file $$file: $!"; + + while ( my $row = $csv->getline( $fh ) ) { + if ( ( $keep_header eq 'n' ) and ($line == 1) ) { } + else { push @csv_matrix, $row; } + $line ++ ; + } + my $status = $csv->eof or $csv->error_diag(); + close $fh; + + return(\@csv_matrix, $status) ; +} +## END of SUB + + +=head2 METHOD write_csv_from_arrays + + ## Description : write a csv file from list of rows + ## Input : $csv, $file_name, $rows + ## Output : $csv_file + ## Usage : my ( $csv_file ) = write_csv_from_arrays( $csv, $file_name, $rows ) ; + +=cut +## START of SUB +sub write_csv_from_arrays { + ## Retrieve Values + my $self = shift ; + my ( $csv, $file_name, $rows ) = @_ ; + + my $fh = undef ; + $csv->eol ("\n"); ## end-of-line string to add to rows + open $fh, ">:encoding(utf8)", "$file_name" or die "$file_name: $!"; + + my $status = $csv->print ($fh, $_) for @{$rows}; + close $fh or die "$file_name: $!"; + + return(\$file_name) ; +} +## END of SUB + +1 ; + + +__END__ + +=head1 SUPPORT + +You can find documentation for this module with the perldoc command. + + perldoc csv.pm + +=head1 Exports + +=over 4 + +=item :ALL is get_csv_object, get_value_from_csv_multi_header + +=back + +=head1 AUTHOR + +Franck Giacomoni E<lt>franck.giacomoni@clermont.inra.frE<gt> + +=head1 LICENSE + +This program is free software; you can redistribute it and/or modify it under the same terms as Perl itself. + +=head1 VERSION + +version 1 : 23 / 10 / 2013 + +version 2 : ?? + +=cut \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/lib/hmdb.pm Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,889 @@ +package lib::hmdb ; + +use strict; +use warnings ; +use Exporter ; +use Carp ; + +use LWP::Simple; +use LWP::UserAgent; +use URI::URL; +use SOAP::Lite; +use Encode; +use HTML::Template ; + +use Data::Dumper ; + +use vars qw($VERSION @ISA @EXPORT %EXPORT_TAGS); + +our $VERSION = "1.0"; +our @ISA = qw(Exporter); +our @EXPORT = qw( extract_sub_mz_lists test_matches_from_hmdb_ua prepare_multi_masses_query get_matches_from_hmdb_ua parse_hmdb_csv_results set_html_tbody_object add_mz_to_tbody_object add_entries_to_tbody_object write_html_skel set_lm_matrix_object set_hmdb_matrix_object_with_ids add_lm_matrix_to_input_matrix write_csv_skel write_csv_one_mass ); +our %EXPORT_TAGS = ( ALL => [qw( extract_sub_mz_lists test_matches_from_hmdb_ua prepare_multi_masses_query get_matches_from_hmdb_ua parse_hmdb_csv_results set_html_tbody_object add_mz_to_tbody_object add_entries_to_tbody_object write_html_skel set_lm_matrix_object set_hmdb_matrix_object_with_ids add_lm_matrix_to_input_matrix write_csv_skel write_csv_one_mass )] ); + +=head1 NAME + +My::Module - An example module + +=head1 SYNOPSIS + + use My::Module; + my $object = My::Module->new(); + print $object->as_string; + +=head1 DESCRIPTION + +This module does not really exist, it +was made for the sole purpose of +demonstrating how POD works. + +=head1 METHODS + +Methods are : + +=head2 METHOD new + + ## Description : new + ## Input : $self + ## Ouput : bless $self ; + ## Usage : new() ; + +=cut + +sub new { + ## Variables + my $self={}; + bless($self) ; + return $self ; +} +### END of SUB + + +=head2 METHOD extract_sub_mz_lists + + ## Description : extract a couples of sublist from a long mz list (more than $HMDB_LIMITS) + ## Input : $HMDB_LIMITS, $masses + ## Output : $sublists + ## Usage : my ( $sublists ) = extract_sub_mz_lists( $HMDB_LIMITS, $masses ) ; + +=cut +## START of SUB +sub extract_sub_mz_lists { + ## Retrieve Values + my $self = shift ; + my ( $masses, $HMDB_LIMITS ) = @_ ; + + my ( @sublists, @sublist ) = ( (), () ) ; + my $nb_mz = 0 ; + my $nb_total_mzs = scalar(@{$masses}) ; + + if ($nb_total_mzs == 0) { + die "The provided mzs list is empty" ; + } + + for ( my $current_pos = 0 ; $current_pos < $nb_total_mzs ; $current_pos++ ) { + + if ( $nb_mz < $HMDB_LIMITS ) { + if ( $masses->[$current_pos] ) { push (@sublist, $masses->[$current_pos]) ; $nb_mz++ ; } # build sub list + } + elsif ( $nb_mz == $HMDB_LIMITS ) { + my @tmp = @sublist ; push (@sublists, \@tmp) ; @sublist = () ; $nb_mz = 0 ; + $current_pos-- ; + } + if ($current_pos == $nb_total_mzs-1) { my @tmp = @sublist ; push (@sublists, \@tmp) ; } + } + return(\@sublists) ; +} +## END of SUB + +=head2 METHOD prepare_multi_masses_query + + ## Description : Generate the adapted format of the mz list for HMDB + ## Input : $masses + ## Output : $hmdb_masses + ## Usage : my ( $hmdb_masses ) = prepare_multi_masses_query( $masses ) ; + +=cut +## START of SUB +sub prepare_multi_masses_query { + ## Retrieve Values + my $self = shift ; + my ( $masses ) = @_ ; + + my $hmdb_masses = undef ; + my $sep = '%0D%0A' ; ## retour chariot encode + my ($nb_masses, $i) = (0, 0) ; + + if ( defined $masses ) { + my @masses = @{$masses} ; + my $nb_masses = scalar ( @masses ) ; + if ( $nb_masses == 0 ) { croak "The input method parameter mass list is empty" ; } + elsif ( $nb_masses >= 150 ) { croak "Your mass list is too long : HMDB allows maximum 150 query masses per request \n" ; } ## Del it --- temporary patch + + foreach my $mass (@masses) { + + if ($i < $nb_masses) { + $hmdb_masses .= $mass.$sep ; + } + elsif ( $i == $nb_masses ) { + $hmdb_masses .= $mass ; + } + else { + last ; + } + $i ++ ; + } + } + else { + croak "No mass list found \n" ; + } + return($hmdb_masses, $nb_masses) ; +} +## END of SUB + +=head2 METHOD test_matches_from_hmdb_ua + + ## Description : test a single query with tests parameters on hmdb - get the status of the complete server infra. + ## Input : none + ## Output : $status_line + ## Usage : my ( $status_line ) = test_matches_from_hmdb_ua( ) ; + +=cut +## START of SUB +sub test_matches_from_hmdb_ua { + ## Retrieve Values + my $self = shift ; + + my @page = () ; + + my $ua = new LWP::UserAgent; + $ua->agent("Mozilla/5.0 (Windows NT 6.1) AppleWebKit/537.36 (KHTML, like Gecko) Chrome/34.0.1847.131 Safari/537.36"); + + my $req = HTTP::Request->new( + POST => 'http://specdb.wishartlab.com/ms/search.csv'); + + $req->content_type('application/x-www-form-urlencoded'); + $req->content('utf8=TRUE&mode=positive&query_masses=420.159317&tolerance=0.000001&database=HMDB&commit=Download Results As CSV'); + + my $res = $ua->request($req); +# print $res->as_string; + my $status_line = $res->status_line ; + ($status_line) = ($status_line =~ /(\d+)/); + + + return (\$status_line) ; +} +## END of SUB + +=head2 METHOD check_state_from_hmdb_ua + + ## Description : check the thhp status of hmdb and kill correctly the script if necessary. + ## Input : $status + ## Output : none + ## Usage : check_state_from_hmdb_ua($status) ; + +=cut +## START of SUB +sub check_state_from_hmdb_ua { + ## Retrieve Values + my $self = shift ; + my ($status) = @_ ; + + if (!defined $$status) { + croak "No http status is defined for the distant server" ; + } + else { + unless ( $$status == 200 ) { + if ( $$status == 504 ) { croak "Gateway Timeout: The HMDB server was acting as a gateway or proxy and did not receive a timely response from the upstream server" ; } + else { + ## None supported http code error ## + } + } + } + + return (1) ; +} +## END of SUB + +=head2 METHOD get_matches_from_hmdb_ua + + ## Description : HMDB querying via an user agent with parameters : mz, delta and molecular species (neutral, pos, neg) + ## Input : $mass, $delta, $mode + ## Output : $results + ## Usage : my ( $results ) = get_matches_from_hmdb( $mass, $delta, $mode ) ; + +=cut +## START of SUB +sub get_matches_from_hmdb_ua { + ## Retrieve Values + my $self = shift ; + my ( $masses, $delta, $mode ) = @_ ; + + my @page = () ; + + my $ua = new LWP::UserAgent; + $ua->agent("Mozilla/5.0 (Windows NT 6.1) AppleWebKit/537.36 (KHTML, like Gecko) Chrome/34.0.1847.131 Safari/537.36"); + + my $req = HTTP::Request->new( + POST => 'http://specdb.wishartlab.com/ms/search.csv'); + + $req->content_type('application/x-www-form-urlencoded'); + $req->content('utf8=TRUE&mode='.$mode.'&query_masses='.$masses.'&tolerance='.$delta.'&database=HMDB&commit=Download Results As CSV'); + + my $res = $ua->request($req); +# print $res->as_string; + if ($res->is_success) { + @page = split ( /\n/, $res->decoded_content ) ; + } else { + my $status_line = $res->status_line ; + ($status_line) = ($status_line =~ /(\d+)/); + croak "HMDB service none available !! Status of the HMDB server is : $status_line\n" ; + } + + + return (\@page) ; +} +## END of SUB + +=head2 METHOD parse_hmdb_csv_results + + ## Description : parse the csv results and get data + ## Input : $csv + ## Output : $results + ## Usage : my ( $results ) = parse_hmdb_csv_results( $csv ) ; + +=cut +## START of SUB +sub parse_hmdb_csv_results { + ## Retrieve Values + my $self = shift ; + my ( $csv, $masses ) = @_ ; + + my $test = 0 ; + my ($query_mass,$compound_id,$formula,$compound_mass,$adduct,$adduct_type,$adduct_mass,$delta) = (0, undef, undef, undef, undef, undef, undef, undef) ; + + my %result_by_entry = () ; + my %features = () ; + +# print Dumper $csv ; + + foreach my $line (@{$csv}) { + + if ($line !~ /query_mass,compound_id,formula,compound_mass,adduct,adduct_type,adduct_mass,delta/) { + my @entry = split(/,/, $line) ; + + if ( !exists $result_by_entry{$entry[0]} ) { $result_by_entry{$entry[0]} = [] ; } + + $features{ENTRY_ENTRY_ID} = $entry[1] ; + $features{ENTRY_FORMULA} = $entry[2] ; + $features{ENTRY_CPD_MZ} = $entry[3] ; + $features{ENTRY_ADDUCT} = $entry[4] ; + $features{ENTRY_ADDUCT_TYPE} = $entry[5] ; + $features{ENTRY_ADDUCT_MZ} = $entry[6] ; + $features{ENTRY_DELTA} = $entry[7] ; + + my %temp = %features ; + + push (@{$result_by_entry{$entry[0]} }, \%temp) ; + } + else { + next ; + } + } ## end foreach + + ## manage per query_mzs (keep query masses order by array) + my @results = () ; + foreach (@{$masses}) { + if ($result_by_entry{$_}) { push (@results, $result_by_entry{$_}) ; } + else {push (@results, [] ) ;} ; + } + return(\@results) ; +} +## END of SUB + +=head2 METHOD parse_hmdb_page_results + + ## Description : [DEPRECATED] old HMDB html page parser + ## Input : $page + ## Output : $results + ## Usage : my ( $results ) = parse_hmdb_page_result( $pages ) ; + +=cut +## START of SUB +sub parse_hmdb_page_results { + ## Retrieve Values + my $self = shift ; + my ( $page ) = @_ ; + + my @results = () ; + my ($catch_table, $catch_name) = (0, 0) ; + my ($name, $adduct, $adduct_mw, $cpd_mw, $delta) = (undef, undef, undef, undef, undef) ; + + if ( defined $page ) { + + my @page = @{$page} ; + my $ID = undef ; + my @result_by_mz = () ; + my %result_by_entry = () ; + + foreach my $line (@page) { + + #Section de la page contenant les resultat + if( $line =~/<table>/ ) { $catch_table = 1 ; } + + ## Si il existe un resultat : + if($catch_table == 1) { + + #Id de la molecule, et creation du lien + if( $line =~ /<a href=\"\/metabolites\/(\w+)\" (.*)>/ ) { + $ID = $1 ; + $catch_name = 0 ; + next ; + } + #Nom de la molecule ONLY!! + if ( $catch_name == 0 ) { + + if( $line =~ /<td>(.+)<\/td>/ ) { + + if ( !defined $name ) { + $name = $1 ; + $result_by_entry{'ENTRY_ENTRY_ID'} = $ID ; + $result_by_entry{'ENTRY_NAME'} = $name ; + next ; + } + if ( !defined $adduct ) { $adduct = $1 ; $result_by_entry{'ENTRY_ADDUCT'} = $adduct ; next ; } + if ( !defined $adduct_mw ) { $adduct_mw = $1 ; $result_by_entry{'ENTRY_ADDUCT_MZ'} = $adduct_mw ; next ; } + if ( !defined $cpd_mw ) { $cpd_mw = $1 ; $result_by_entry{'ENTRY_CPD_MZ'} = $cpd_mw ; next ; } + if ( !defined $delta ) { + $delta = $1 ; + $result_by_entry{'ENTRY_DELTA'} = $delta ; + $catch_name = 1 ; + my %tmp = %result_by_entry ; + push (@result_by_mz, \%tmp) ; + %result_by_entry = () ; + ( $name, $cpd_mw, $delta, $adduct, $adduct_mw ) = ( undef, undef, undef, undef, undef ) ; + next ; + } + } + } + } + #Fin de la section contenant les resultats + if( $line =~ /<\/table>/ ) { + $catch_table = 0 ; + my @Tmp = @result_by_mz ; + push(@results, \@Tmp) ; + @result_by_mz = () ; + } + } + } + return(\@results) ; +} +## END of SUB + +=head2 METHOD set_html_tbody_object + + ## Description : initializes and build the tbody object (perl array) needed to html template + ## Input : $nb_pages, $nb_items_per_page + ## Output : $tbody_object + ## Usage : my ( $tbody_object ) = set_html_tbody_object($nb_pages, $nb_items_per_page) ; + +=cut +## START of SUB +sub set_html_tbody_object { + my $self = shift ; + my ( $nb_pages, $nb_items_per_page ) = @_ ; + + my ( @tbody_object ) = ( ) ; + + for ( my $i = 1 ; $i <= $nb_pages ; $i++ ) { + + my %pages = ( + # tbody feature + PAGE_NB => $i, + MASSES => [], ## end MASSES + ) ; ## end TBODY N + push (@tbody_object, \%pages) ; + } + return(\@tbody_object) ; +} +## END of SUB + +=head2 METHOD add_mz_to_tbody_object + + ## Description : initializes and build the mz object (perl array) needed to html template + ## Input : $tbody_object, $nb_items_per_page, $mz_list + ## Output : $tbody_object + ## Usage : my ( $tbody_object ) = add_mz_to_tbody_object( $tbody_object, $nb_items_per_page, $mz_list ) ; + +=cut +## START of SUB +sub add_mz_to_tbody_object { + my $self = shift ; + my ( $tbody_object, $nb_items_per_page, $mz_list, $ids_list ) = @_ ; + + my ( $current_page, $mz_index ) = ( 0, 0 ) ; + + foreach my $page ( @{$tbody_object} ) { + + my @colors = ('white', 'green') ; + my ( $current_index, , $icolor ) = ( 0, 0 ) ; + + for ( my $i = 1 ; $i <= $nb_items_per_page ; $i++ ) { + # + if ( $current_index > $nb_items_per_page ) { ## manage exact mz per html page + $current_index = 0 ; + last ; ## + } + else { + $current_index++ ; + if ( $icolor > 1 ) { $icolor = 0 ; } + + if ( exists $mz_list->[$mz_index] ) { + + my %mz = ( + # mass feature + MASSES_ID_QUERY => $ids_list->[$mz_index], + MASSES_MZ_QUERY => $mz_list->[$mz_index], + MZ_COLOR => $colors[$icolor], + MASSES_NB => $mz_index+1, + ENTRIES => [] , + ) ; + push ( @{ $tbody_object->[$current_page]{MASSES} }, \%mz ) ; + # Html attr for mass + $icolor++ ; + } + } + $mz_index++ ; + } ## foreach mz + + $current_page++ ; + } + return($tbody_object) ; +} +## END of SUB + +=head2 METHOD add_entries_to_tbody_object + + ## Description : initializes and build the entries object (perl array) needed to html template + ## Input : $tbody_object, $nb_items_per_page, $mz_list, $entries + ## Output : $tbody_object + ## Usage : my ( $tbody_object ) = add_entries_to_tbody_object( $tbody_object, $nb_items_per_page, $mz_list, $entries ) ; + +=cut +## START of SUB +sub add_entries_to_tbody_object { + ## Retrieve Values + my $self = shift ; + my ( $tbody_object, $nb_items_per_page, $mz_list, $entries ) = @_ ; + + my $index_page = 0 ; + my $index_mz_continous = 0 ; + + foreach my $page (@{$tbody_object}) { + + my $index_mz = 0 ; + + foreach my $mz (@{ $tbody_object->[$index_page]{MASSES} }) { + + my $index_entry = 0 ; + + my @anti_redondant = ('N/A') ; + my $check_rebond = 0 ; + my $check_noentry = 0 ; + + foreach my $entry (@{ $entries->[$index_mz_continous] }) { + $check_noentry ++ ; + ## dispo anti doublons des entries + foreach my $rebond (@anti_redondant) { + if ( $rebond eq $entries->[$index_mz_continous][$index_entry]{ENTRY_ENTRY_ID} ) { $check_rebond = 1 ; last ; } + } + + if ( $check_rebond == 0 ) { + + push ( @anti_redondant, $entries->[$index_mz_continous][$index_entry]{ENTRY_ENTRY_ID} ) ; + + my %entry = ( + ENTRY_COLOR => $tbody_object->[$index_page]{MASSES}[$index_mz]{MZ_COLOR}, + ENTRY_ENTRY_ID => $entries->[$index_mz_continous][$index_entry]{ENTRY_ENTRY_ID}, + ENTRY_ENTRY_ID2 => $entries->[$index_mz_continous][$index_entry]{ENTRY_ENTRY_ID}, + ENTRY_FORMULA => $entries->[$index_mz_continous][$index_entry]{ENTRY_FORMULA}, + ENTRY_CPD_MZ => $entries->[$index_mz_continous][$index_entry]{ENTRY_CPD_MZ}, + ENTRY_ADDUCT => $entries->[$index_mz_continous][$index_entry]{ENTRY_ADDUCT}, + ENTRY_ADDUCT_TYPE => $entries->[$index_mz_continous][$index_entry]{ENTRY_ADDUCT_TYPE}, + ENTRY_ADDUCT_MZ => $entries->[$index_mz_continous][$index_entry]{ENTRY_ADDUCT_MZ}, + ENTRY_DELTA => $entries->[$index_mz_continous][$index_entry]{ENTRY_DELTA}, + ) ; + + push ( @{ $tbody_object->[$index_page]{MASSES}[$index_mz]{ENTRIES} }, \%entry) ; + } + $check_rebond = 0 ; ## reinit double control + $index_entry++ ; + } ## end foreach + if ($check_noentry == 0 ) { + my %entry = ( + ENTRY_COLOR => $tbody_object->[$index_page]{MASSES}[$index_mz]{MZ_COLOR}, + ENTRY_ENTRY_ID => 'No_result_found_on_HMDB', + ENTRY_ENTRY_ID2 => '', + ENTRY_FORMULA => 'n/a', + ENTRY_CPD_MZ => 'n/a', + ENTRY_ADDUCT => 'n/a', + ENTRY_ADDUCT_TYPE => 'n/a', + ENTRY_ADDUCT_MZ => 'n/a', + ENTRY_DELTA => 0, + ) ; + push ( @{ $tbody_object->[$index_page]{MASSES}[$index_mz]{ENTRIES} }, \%entry) ; + } + $index_mz ++ ; + $index_mz_continous ++ ; + } + $index_page++ ; + } + return($tbody_object) ; +} +## END of SUB + +=head2 METHOD write_html_skel + + ## Description : prepare and write the html output file + ## Input : $html_file_name, $html_object, $html_template + ## Output : $html_file_name + ## Usage : my ( $html_file_name ) = write_html_skel( $html_file_name, $html_object ) ; + +=cut +## START of SUB +sub write_html_skel { + ## Retrieve Values + my $self = shift ; + my ( $html_file_name, $html_object, $pages , $search_condition, $html_template, $js_path, $css_path ) = @_ ; + + my $html_file = $$html_file_name ; + + if ( defined $html_file ) { + open ( HTML, ">$html_file" ) or die "Can't create the output file $html_file " ; + + if (-e $html_template) { + my $ohtml = HTML::Template->new(filename => $html_template); + $ohtml->param( JS_GALAXY_PATH => $js_path, CSS_GALAXY_PATH => $css_path ) ; + $ohtml->param( CONDITIONS => $search_condition ) ; + $ohtml->param( PAGES_NB => $pages ) ; + $ohtml->param( PAGES => $html_object ) ; + print HTML $ohtml->output ; + } + else { + croak "Can't fill any html output : No template available ($html_template)\n" ; + } + + close (HTML) ; + } + else { + croak "No output file name available to write HTML file\n" ; + } + return(\$html_file) ; +} +## END of SUB + +=head2 METHOD set_lm_matrix_object + + ## Description : build the hmdb_row under its ref form + ## Input : $header, $init_mzs, $entries + ## Output : $hmdb_matrix + ## Usage : my ( $hmdb_matrix ) = set_lm_matrix_object( $header, $init_mzs, $entries ) ; + +=cut +## START of SUB +sub set_lm_matrix_object { + ## Retrieve Values + my $self = shift ; + my ( $header, $init_mzs, $entries ) = @_ ; + + my @hmdb_matrix = () ; + + if ( defined $header ) { + my @headers = () ; + push @headers, $header ; + push @hmdb_matrix, \@headers ; + } + + my $index_mz = 0 ; + + foreach my $mz ( @{$init_mzs} ) { + + my $index_entries = 0 ; + my @clusters = () ; + my $cluster_col = undef ; + + my @anti_redondant = ('N/A') ; + my $check_rebond = 0 ; + + my $nb_entries = scalar (@{ $entries->[$index_mz] }) ; + + foreach my $entry (@{ $entries->[$index_mz] }) { + + ## dispo anti doublons des entries + foreach my $rebond (@anti_redondant) { + if ( $rebond eq $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ) { $check_rebond = 1 ; last ; } + } + + if ( $check_rebond == 0 ) { + + push ( @anti_redondant, $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ) ; + + my $delta = $entries->[$index_mz][$index_entries]{ENTRY_DELTA} ; + my $formula = $entries->[$index_mz][$index_entries]{ENTRY_FORMULA} ; + my $hmdb_id = $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ; + + ## METLIN data display model + ## entry1=VAR1::VAR2::VAR3::VAR4|entry2=VAR1::VAR2::VAR3::VAR4|... + # manage final pipe + if ($index_entries < $nb_entries-1 ) { $cluster_col .= $delta.'::('.$formula.')::'.$hmdb_id.'|' ; } + else { $cluster_col .= $delta.'::('.$formula.')::'.$hmdb_id ; } + + } + $check_rebond = 0 ; ## reinit double control + $index_entries++ ; + } ## end foreach + if ( !defined $cluster_col ) { $cluster_col = 'No_result_found_on_HMDB' ; } + push (@clusters, $cluster_col) ; + push (@hmdb_matrix, \@clusters) ; + $index_mz++ ; + } + return(\@hmdb_matrix) ; +} +## END of SUB + +=head2 METHOD set_hmdb_matrix_object_with_ids + + ## Description : build the hmdb_row under its ref form (IDS only) + ## Input : $header, $init_mzs, $entries + ## Output : $hmdb_matrix + ## Usage : my ( $hmdb_matrix ) = set_hmdb_matrix_object_with_ids( $header, $init_mzs, $entries ) ; + +=cut +## START of SUB +sub set_hmdb_matrix_object_with_ids { + ## Retrieve Values + my $self = shift ; + my ( $header, $init_mzs, $entries ) = @_ ; + + my @hmdb_matrix = () ; + + if ( defined $header ) { + my @headers = () ; + push @headers, $header ; + push @hmdb_matrix, \@headers ; + } + + my $index_mz = 0 ; + + foreach my $mz ( @{$init_mzs} ) { + + my $index_entries = 0 ; + my @clusters = () ; + my $cluster_col = undef ; + + my @anti_redondant = ('N/A') ; + my $check_rebond = 0 ; + + my $nb_entries = scalar (@{ $entries->[$index_mz] }) ; + + foreach my $entry (@{ $entries->[$index_mz] }) { + + ## dispo anti doublons des entries + foreach my $rebond (@anti_redondant) { + if ( $rebond eq $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ) { $check_rebond = 1 ; last ; } + } + + if ( $check_rebond == 0 ) { + + push ( @anti_redondant, $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ) ; + my $hmdb_id = $entries->[$index_mz][$index_entries]{ENTRY_ENTRY_ID} ; + + ## METLIN data display model -- IDs ONLY !! + ## entry1=VAR1::VAR2::VAR3::VAR4|entry2=VAR1::VAR2::VAR3::VAR4|... + # manage final pipe + if ($index_entries < $nb_entries-1 ) { $cluster_col .= $hmdb_id.'|' ; } + else { $cluster_col .= $hmdb_id ; } + + } + $check_rebond = 0 ; ## reinit double control + $index_entries++ ; + } ## end foreach + if ( !defined $cluster_col ) { $cluster_col = 'No_result_found_on_HMDB' ; } + push (@clusters, $cluster_col) ; + push (@hmdb_matrix, \@clusters) ; + $index_mz++ ; + } + return(\@hmdb_matrix) ; +} +## END of SUB + +=head2 METHOD add_lm_matrix_to_input_matrix + + ## Description : build a full matrix (input + lm column) + ## Input : $input_matrix_object, $lm_matrix_object, $nb_header + ## Output : $output_matrix_object + ## Usage : my ( $output_matrix_object ) = add_lm_matrix_to_input_matrix( $input_matrix_object, $lm_matrix_object, $nb_header ) ; + +=cut +## START of SUB +sub add_lm_matrix_to_input_matrix { + ## Retrieve Values + my $self = shift ; + my ( $input_matrix_object, $lm_matrix_object, $nb_header ) = @_ ; + + my @output_matrix_object = () ; + my $index_row = 0 ; + my $line = 0 ; + + foreach my $row ( @{$input_matrix_object} ) { + my @init_row = @{$row} ; + $line++; + + if ( ( defined $nb_header ) and ( $line <= $nb_header) ) { + push (@output_matrix_object, \@init_row) ; + next ; + } + + if ( $lm_matrix_object->[$index_row] ) { + my $dim = scalar(@{$lm_matrix_object->[$index_row]}) ; + + if ($dim > 1) { warn "the add method can't manage more than one column\n" ;} + my $lm_col = $lm_matrix_object->[$index_row][$dim-1] ; + + push (@init_row, $lm_col) ; + $index_row++ ; + } + push (@output_matrix_object, \@init_row) ; + } + return(\@output_matrix_object) ; +} +## END of SUB + +=head2 METHOD write_csv_skel + + ## Description : prepare and write csv output file + ## Input : $csv_file, $rows + ## Output : $csv_file + ## Usage : my ( $csv_file ) = write_csv_skel( $csv_file, $rows ) ; + +=cut +## START of SUB +sub write_csv_skel { + ## Retrieve Values + my $self = shift ; + my ( $csv_file, $rows ) = @_ ; + + my $ocsv = lib::csv::new() ; + my $csv = $ocsv->get_csv_object("\t") ; + $ocsv->write_csv_from_arrays($csv, $$csv_file, $rows) ; + + return($csv_file) ; +} +## END of SUB + +=head2 METHOD write_csv_one_mass + + ## Description : print a cvs file + ## Input : $masses, $ids, $results, $file + ## Output : N/A + ## Usage : write_csv_one_mass( $ids, $results, $file ) ; + +=cut +## START of SUB +sub write_csv_one_mass { + ## Retrieve Values + my $self = shift ; + my ( $masses, $ids, $results, $file, ) = @_ ; + + open(CSV, '>:utf8', "$file") or die "Cant' create the file $file\n" ; + print CSV "ID\tMASS_SUBMIT\tHMDB_ID\tCPD_FORMULA\tCPD_MW\tDELTA\n" ; + + my $i = 0 ; + + foreach my $id (@{$ids}) { + my $mass = undef ; + if ( $masses->[$i] ) { $mass = $masses->[$i] ; } + else { last ; } + + if ( $results->[$i] ) { ## an requested id has a result in the list of hashes $results. + + my @anti_redondant = ('N/A') ; + my $check_rebond = 0 ; + my $check_noentry = 0 ; + + foreach my $entry (@{$results->[$i]}) { + $check_noentry ++ ; + ## dispo anti doublons des entries + foreach my $rebond (@anti_redondant) { + if ( $rebond eq $entry->{ENTRY_ENTRY_ID} ) { $check_rebond = 1 ; last ; } + } +# print "\n-----------------------" ; +# print Dumper $entry->{ENTRY_ENTRY_ID} ; +# print "-------------------------$check_rebond\n" ; +# print Dumper @anti_redondant ; + if ( $check_rebond == 0 ) { + + push ( @anti_redondant, $entry->{ENTRY_ENTRY_ID} ) ; + + print CSV "$id\t$mass\t$entry->{ENTRY_ENTRY_ID}\t" ; + ## print cpd name + if ( $entry->{ENTRY_FORMULA} ) { print CSV "$entry->{ENTRY_FORMULA}\t" ; } + else { print CSV "N/A\t" ; } + ## print cpd mw + if ( $entry->{ENTRY_CPD_MZ} ) { print CSV "$entry->{ENTRY_CPD_MZ}\t" ; } + else { print CSV "N/A\t" ; } + ## print delta + if ( $entry->{ENTRY_DELTA} ) { print CSV "$entry->{ENTRY_DELTA}\n" ; } + else { print CSV "N/A\n" ; } + } + $check_rebond = 0 ; ## reinit double control + } ## end foreach + if ($check_noentry == 0 ) { + print CSV "$id\t$mass\t".'No_result_found_on_HMDB'."\tn/a\tn/a\t0\n" ; + } + } + $i++ ; + } + close(CSV) ; + return() ; +} +## END of SUB + +1 ; + + +__END__ + +=head1 SUPPORT + +You can find documentation for this module with the perldoc command. + + perldoc hmdb.pm + +=head1 Exports + +=over 4 + +=item :ALL is ... + +=back + +=head1 AUTHOR + +Franck Giacomoni E<lt>franck.giacomoni@clermont.inra.frE<gt> + +=head1 LICENSE + +This program is free software; you can redistribute it and/or modify it under the same terms as Perl itself. + +=head1 VERSION + +version 1 : 06 / 06 / 2013 + +version 2 : 27 / 01 / 2014 + +version 3 : 19 / 11 / 2014 + +version 4 : 28 / 01 / 2016 + +=cut
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/t/hmdb_managerTest.pl Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,134 @@ +#! perl +use diagnostics; +use warnings; +no warnings qw/void/; +use strict; +no strict "refs" ; +use Test::More qw( no_plan ); +use Test::Exception; +use FindBin ; +use Carp ; + +## Specific Modules +use lib $FindBin::Bin ; +my $binPath = $FindBin::Bin ; +use lib::hmdbTest qw( :ALL ) ; + + +## To launch the right sequence : API, MAPPER, THREADER, ... +#my $sequence = 'MAPPER' ; +my $sequence = 'MAIN' ; +my $current_test = 1 ; + +if ($sequence eq "MAIN") { + print "\n\t\t\t\t * * * * * * \n" ; + print "\t * * * - - - Test HMDB Main script - - - * * * \n\n" ; + + + print "\n** Test $current_test extract_sub_mz_lists with an empty list of mzs **\n" ; $current_test++; + + throws_ok{ extract_sub_mz_listsTest([], 3)} '/The provided mzs list is empty/', 'Method \'extract_sub_mz_lists\' detects empty argument and died correctly' ; + + print "\n** Test $current_test extract_sub_mz_lists with a list of mzs and a limit of 3 **\n" ; $current_test++; + is_deeply( extract_sub_mz_listsTest( + ['175.01', '238.19', '420.16', '780.32', '956.25', '1100.45' ], 3), + [ [ '175.01', '238.19', '420.16' ], [ '780.32', '956.25', '1100.45' ] ], + 'Method \'extract_sub_mz_lists\' works with a list and return a well formated list of sublist of mzs'); + + print "\n** Test $current_test prepare_multi_masses_query with an empty list of mzs **\n" ; $current_test++; + throws_ok{ prepare_multi_masses_queryTest([])} '/The input method parameter mass list is empty/', 'Method \'prepare_multi_masses_query\' detects empty argument and died correctly' ; + + print "\n** Test $current_test prepare_multi_masses_query with a list of mzs **\n" ; $current_test++; + is_deeply( prepare_multi_masses_queryTest( + ['175.01', '238.19', '420.16', '780.32', '956.25', '1100.45' ] ), + '175.01%0D%0A238.19%0D%0A420.16%0D%0A780.32%0D%0A956.25%0D%0A1100.45%0D%0A', + 'Method \'prepare_multi_masses_query\' works with a list of and return a well formated string for hmdb querying'); + + print "\n** Test $current_test get_matches_from_hmdb_ua with a well-formated string of mzs **\n" ; $current_test++; + is_deeply( get_matches_from_hmdb_uaTest( + '175.01%0D%0A420.16%0D%0A780.32%0D%0A956.25%0D%0A1100.45%0D%0A', 0.001, 'positive'), + [ + 'query_mass,compound_id,formula,compound_mass,adduct,adduct_type,adduct_mass,delta', + '175.01,HMDB60293,H2O3S2,113.94453531,M+IsoProp+H,+,175.009875,0.000125', + '175.01,HMDB03745,C2H6O3S2,141.975835438,M+CH3OH+H,+,175.009324,0.000676', + '175.01,HMDB31436,H4O4Si,95.987885149,M+DMSO+H,+,175.009105,0.000895', + '175.01,HMDB33657,C17H10O6,310.047738052,M+H+K,+,175.009086,0.000914', + '175.01,HMDB35230,C17H10O6,310.047738052,M+H+K,+,175.009086,0.000914', + '420.16,HMDB60838,C17H17N3O4S,359.093976737,M+IsoProp+H,+,420.159317,0.000683', + '420.16,HMDB60836,C17H17N3O4S,359.093976737,M+IsoProp+H,+,420.159317,0.000683' + ], + 'Method \'get_matches_from_hmdb_ua\' works with a well-formated string of mzs and return a complete csv from hmdb'); + + print "\n** Test $current_test test_matches_from_hmdb_ua to get hmdb status **\n" ; $current_test++; + is_deeply (test_matches_from_hmdb_uaTest (), + \'200', + 'The HMDB server is available: returns successful HTTP requests' ) ; + + print "\n** Test $current_test check_state_from_hmdb_ua to manage script execution with the hmdb server status **\n" ; $current_test++; + is_deeply (check_state_from_hmdb_uaTest (\'200'), + 1, + 'The status 200 returns no error/warn' ) ; + + print "\n** Test $current_test prepare_multi_masses_query with an empty list of mzs **\n" ; $current_test++; + throws_ok{ check_state_from_hmdb_uaTest(\'504')} + '/Gateway Timeout: The HMDB server was acting as a gateway or proxy and did not receive a timely response from the upstream server/', + 'Method \'check_state_from_hmdb_ua\' detects HTTP error code returned by HMDB and died correctly' ; + + print "\n** Test $current_test parse_hmdb_csv_results with the correct inputs for hmdb outputs parsing (csv format) **\n" ; $current_test++; + is_deeply ( parse_hmdb_csv_resultsTest ( + [ + 'query_mass,compound_id,formula,compound_mass,adduct,adduct_type,adduct_mass,delta', + '175.01,HMDB60293,H2O3S2,113.94453531,M+IsoProp+H,+,175.009875,0.000125', + '175.01,HMDB03745,C2H6O3S2,141.975835438,M+CH3OH+H,+,175.009324,0.000676', + '175.01,HMDB31436,H4O4Si,95.987885149,M+DMSO+H,+,175.009105,0.000895', + '175.01,HMDB33657,C17H10O6,310.047738052,M+H+K,+,175.009086,0.000914', + '175.01,HMDB35230,C17H10O6,310.047738052,M+H+K,+,175.009086,0.000914', + '420.16,HMDB60838,C17H17N3O4S,359.093976737,M+IsoProp+H,+,420.159317,0.000683', + '420.16,HMDB60836,C17H17N3O4S,359.093976737,M+IsoProp+H,+,420.159317,0.000683' + ], + ['175.01', '238.19', '420.16'] + ), + [ + [ + { 'ENTRY_ADDUCT' => 'M+IsoProp+H', 'ENTRY_DELTA' => '0.000125', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_FORMULA' => 'H2O3S2', 'ENTRY_ENTRY_ID' => 'HMDB60293', 'ENTRY_ADDUCT_MZ' => '175.009875', 'ENTRY_CPD_MZ' => '113.94453531' }, + { 'ENTRY_ADDUCT' => 'M+CH3OH+H', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_DELTA' => '0.000676', 'ENTRY_FORMULA' => 'C2H6O3S2', 'ENTRY_ENTRY_ID' => 'HMDB03745', 'ENTRY_ADDUCT_MZ' => '175.009324', 'ENTRY_CPD_MZ' => '141.975835438' }, + { 'ENTRY_CPD_MZ' => '95.987885149', 'ENTRY_FORMULA' => 'H4O4Si', 'ENTRY_ENTRY_ID' => 'HMDB31436', 'ENTRY_ADDUCT_MZ' => '175.009105', 'ENTRY_DELTA' => '0.000895', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_ADDUCT' => 'M+DMSO+H' }, + { 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_DELTA' => '0.000914', 'ENTRY_ADDUCT' => 'M+H+K', 'ENTRY_CPD_MZ' => '310.047738052', 'ENTRY_ENTRY_ID' => 'HMDB33657', 'ENTRY_ADDUCT_MZ' => '175.009086', 'ENTRY_FORMULA' => 'C17H10O6' }, + { 'ENTRY_ADDUCT' => 'M+H+K', 'ENTRY_DELTA' => '0.000914', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_FORMULA' => 'C17H10O6', 'ENTRY_ADDUCT_MZ' => '175.009086', 'ENTRY_ENTRY_ID' => 'HMDB35230', 'ENTRY_CPD_MZ' => '310.047738052' } + ], + [], + [ + { 'ENTRY_ADDUCT' => 'M+IsoProp+H', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_DELTA' => '0.000683', 'ENTRY_ENTRY_ID' => 'HMDB60838', 'ENTRY_ADDUCT_MZ' => '420.159317', 'ENTRY_FORMULA' => 'C17H17N3O4S', 'ENTRY_CPD_MZ' => '359.093976737' }, + { 'ENTRY_CPD_MZ' => '359.093976737', 'ENTRY_FORMULA' => 'C17H17N3O4S', 'ENTRY_ENTRY_ID' => 'HMDB60836', 'ENTRY_ADDUCT_MZ' => '420.159317', 'ENTRY_ADDUCT_TYPE' => '+', 'ENTRY_DELTA' => '0.000683', 'ENTRY_ADDUCT' => 'M+IsoProp+H' } + ] + ], + 'Method \'parse_hmdb_csv_results\' works with a well-formated csv output and returns a a well formated array' ) ; + + print "\n** Test $current_test parse_hmdb_csv_results with a void hmdb output and a list of mzs **\n" ; $current_test++; + is_deeply ( parse_hmdb_csv_resultsTest ( [], ['175.01', '238.19', '420.16'] ), + [ [], [], [] ], + 'Method \'parse_hmdb_csv_results\' works with a empty csv output and returns an empty but well formatted array' ) ; + + print "\n** Test $current_test parse_hmdb_csv_results with a void hmdb output and a void mz list **\n" ; $current_test++; + is_deeply ( parse_hmdb_csv_resultsTest ( [], [] ), + [], + 'Method \'parse_hmdb_csv_results\' works with a empty csv output/mz list and returns an empty but well formatted array' ) ; +} + + + + + + + + + + + + + + + + + +## END of the script \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/t/lib/hmdbTest.pm Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,83 @@ +package lib::hmdbTest ; + +use diagnostics; # this gives you more debugging information +use warnings; # this warns you of bad practices +use strict; # this prevents silly errors +use Exporter ; +use Carp ; + +our $VERSION = "1.0"; +our @ISA = qw(Exporter); +our @EXPORT = qw( parse_hmdb_csv_resultsTest check_state_from_hmdb_uaTest test_matches_from_hmdb_uaTest extract_sub_mz_listsTest prepare_multi_masses_queryTest get_matches_from_hmdb_uaTest); +our %EXPORT_TAGS = ( ALL => [qw( parse_hmdb_csv_resultsTest check_state_from_hmdb_uaTest test_matches_from_hmdb_uaTest extract_sub_mz_listsTest prepare_multi_masses_queryTest get_matches_from_hmdb_uaTest)] ); + +use lib '/Users/fgiacomoni/Inra/labs/perl/galaxy_tools/hmdb' ; +use lib::hmdb qw( :ALL ) ; + +use Data::Dumper ; + +## sub +sub extract_sub_mz_listsTest { + + my ($masses, $hmdb_limits, ) = @_ ; + + my $oHmdb = lib::hmdb->new() ; + my $submasses = $oHmdb->extract_sub_mz_lists($masses, $hmdb_limits ) ; + + return ($submasses) ; +} + +## sub +sub prepare_multi_masses_queryTest { + + my ($mzs ) = @_ ; + + my $oHmdb = lib::hmdb->new() ; + my ( $hmdb_masses, $nb_masses_to_submit ) = $oHmdb->prepare_multi_masses_query($mzs) ; + + return ($hmdb_masses) ; +} + +## sub +sub get_matches_from_hmdb_uaTest { + + my ( $hmdb_masses, $delta, $molecular_species ) = @_ ; + + my $oHmdb = lib::hmdb->new() ; + my $hmdb_pages = $oHmdb->get_matches_from_hmdb_ua($hmdb_masses, $delta, $molecular_species) ; + return ($hmdb_pages) ; +} + + +## sub +sub test_matches_from_hmdb_uaTest { + + my $oHmdb = lib::hmdb->new() ; + my $status = $oHmdb->test_matches_from_hmdb_ua() ; + return ($status) ; +} + + +## sub +sub check_state_from_hmdb_uaTest { + my ($status ) = @_ ; + + my $oHmdb = lib::hmdb->new() ; + my $res = $oHmdb->check_state_from_hmdb_ua($status) ; + return($res) ; +} + + + +## sub +sub parse_hmdb_csv_resultsTest { + my ($hmdb_pages, $mzs ) = @_ ; + + my $oHmdb = lib::hmdb->new() ; + my $result = $oHmdb->parse_hmdb_csv_results($hmdb_pages, $mzs) ; ## hash format result + + return($result) ; +} + + +1 ; \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/input_test01_fake-mzrt-input-with-id.tsv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,7 @@ +id mz rt +1 7.02080998 49.38210915 +2 75.05547146 0.658528069 +3 75.08059797 1743.94267 +4 76.03942694 51.23158899 +5 76.07584477 50.51249853 +6 76.07593168 0.149308136 \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/input_test02_mzrt-input-with-id.tsv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,7 @@ +id mz rt +1 7.02080998 49.38210915 +2 75.05547146 0.658528069 +3 75.08059797 1743.94267 +4 76.03942694 51.23158899 +5 76.07584477 50.51249853 +6 76.07593168 0.149308136 \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test01.csv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,7 @@ +ID MASS_SUBMIT HMDB_ID CPD_FORMULA CPD_MW DELTA +mz_00001 7.02080998 No_result_found_on_HMDB n/a n/a 0 +mz_00002 75.05547146 No_result_found_on_HMDB n/a n/a 0 +mz_00003 75.08059797 No_result_found_on_HMDB n/a n/a 0 +mz_00004 76.03942694 No_result_found_on_HMDB n/a n/a 0 +mz_00005 76.07584477 No_result_found_on_HMDB n/a n/a 0 +mz_00006 76.07593168 No_result_found_on_HMDB n/a n/a 0
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test01.html Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1 @@ +<?xml version="1.0" encoding="UTF-8" ?><!DOCTYPE html><html lang="en"><head><meta charset="utf-8"><meta name="viewport" content="width=device-width, initial-scale=1.0"><meta name="description" content=""><meta name="author" content="INRA de Clermont-Ferrand"><title>Galaxy HMDB queries - All results</title><link rel="stylesheet" type="text/css" href="css.php" media="all"><link rel="stylesheet" type="text/css" href="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/style/simplePagination.css"/><!-- JavaScript --><script src="https://ajax.googleapis.com/ajax/libs/jquery/1.7.2/jquery.min.js"></script><script src="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/scripts/jquery.simplePagination.js"></script><style type="text/css">body {padding-top: 70px}div.lm-table-warning { font-size: 1.4em; font-weight: bold; padding-right: 25px; color: #21536a; margin-left: 3px;}tr.green td {background-color: #eaf2d3; color: black;}tr.blank td {background-color: #9999CC; color: black;}table {font-family:'Trebuchet MS',Arial,Helvetica,sans-serif;width:100%;border-collapse:collapse;}table.detail, table.detail tr.parent, table.detail td, table.detail th, table.detail tr.category {border-collapse:collapse;border:1px solid #98bf21;}table.detail th {font-size: 1.2em;text-align: center;padding-top: 5px;padding-bottom: 10px;background-color: #a7c942;color: #ffffff;}td.ca {text-align:center;}footer { margin: 50px 0;}</style><script>function test(pageNumber){ var page="#page-id-"+pageNumber; $('.select').hide() ; $(page).show()}</script></head><body><div class="container"><div class="lm-table-warning">Results of HMDB queries - Search params : Molecular specie = neutral / delta (mass-to-charge ratio) = 0.001</div><div id="detail_table_source" style="display:none"></div><p><div id="choose"></div><p><div id="ms_search_0" class="ms-search-table"></div><!-- HeadRows--><table id="detail_table" class="detail"><col style="width:30px;"><!-- Ids (m/z)--><col style="width:30px;"><!-- Mass (m/z)--><col style="width:30px;"><!-- Compound--><col style="width:120px;"><!-- name--><col style="width:40px;"><!-- adduct--><col style="width:50px;"><!-- adduct type--><col style="width:60px;"><!-- adduct mw--><col style="width:60px;"><!-- cpd mw--><col style="width:50px;"><!-- delta--><thead><th>ID from input</th><th>Mass (m/z)</th><th>Compound_ID</th><th>Formula</th><th>Compound MW (Da)</th><th>Adduct</th><th>Adduct_Type</th><th>Adduct MW (Da)</th><th>Delta</th></thead><tbody class="select" id="page-id-1"><tr class="white"><td class="ca" >mz_00001</td><td id="1" class="ca" >7.02080998</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr><tr class="green"><td class="ca" >mz_00002</td><td id="2" class="ca" >75.05547146</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr><tr class="white"><td class="ca" >mz_00003</td><td id="3" class="ca" >75.08059797</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr><tr class="green"><td class="ca" >mz_00004</td><td id="4" class="ca" >76.03942694</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr></tbody><tbody class="select" id="page-id-2"><tr class="white"><td class="ca" >mz_00005</td><td id="5" class="ca" >76.07584477</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr><tr class="green"><td class="ca" >mz_00006</td><td id="6" class="ca" >76.07593168</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr></tbody></table></div><div class="container"><hr><footer><div class="row"> <div class="col-lg-12"><p>Copyright © INRA, N Paulhe, F Giacomoni 2014 </p> </div> </div> </footer></div><script language="javascript">$(function() {$('#choose').pagination({items: 2,itemsOnPage: 1,currentPage: 1,onInit: function () { test(1); },cssStyle: 'light-theme',onPageClick: function(pageNumber){test(pageNumber)}}).pagination('redraw');});</script></body></html> \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test01.tsv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,7 @@ +id mz rt hmdb +1 7.02080998 49.38210915 No_result_found_on_HMDB +2 75.05547146 0.658528069 No_result_found_on_HMDB +3 75.08059797 1743.94267 No_result_found_on_HMDB +4 76.03942694 51.23158899 No_result_found_on_HMDB +5 76.07584477 50.51249853 No_result_found_on_HMDB +6 76.07593168 0.149308136 No_result_found_on_HMDB
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test02.csv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,75 @@ +ID MASS_SUBMIT HMDB_ID CPD_FORMULA CPD_MW DELTA +mz_00001 7.02080998 No_result_found_on_HMDB n/a n/a 0 +mz_00002 75.05547146 HMDB31419 C2H6N2O 74.048012824 0.00018246 +mz_00002 75.05547146 HMDB60428 C2H6N2O 74.048012824 0.00018246 +mz_00002 75.05547146 HMDB00064 C4H9N3O2 131.069476547 0.00018346 +mz_00002 75.05547146 HMDB13222 C4H9N3O2 131.069476547 0.00018346 +mz_00002 75.05547146 HMDB32439 H3NO 33.021463723 0.00018446 +mz_00002 75.05547146 HMDB03338 H3NO 33.021463723 0.00018446 +mz_00002 75.05547146 HMDB13162 C11H22NO2 200.165053953 0.00080354 +mz_00003 75.08059797 HMDB04327 C4H10O 74.073164942 0.00015697 +mz_00003 75.08059797 HMDB62103 C4H10O 74.073164942 0.00015697 +mz_00003 75.08059797 HMDB11469 C4H10O 74.073164942 0.00015697 +mz_00003 75.08059797 HMDB06006 C4H10O 74.073164942 0.00015697 +mz_00003 75.08059797 HMDB31456 C4H10O 74.073164942 0.00015697 +mz_00004 76.03942694 HMDB00191 C4H7NO4 133.037507717 0.00012294 +mz_00004 76.03942694 HMDB31239 C2H5NO2 75.032028409 0.00012294 +mz_00004 76.03942694 HMDB00123 C2H5NO2 75.032028409 0.00012294 +mz_00004 76.03942694 HMDB14691 C2H5NO2 75.032028409 0.00012294 +mz_00004 76.03942694 HMDB11753 C4H7NO4 133.037507717 0.00012294 +mz_00004 76.03942694 HMDB06483 C4H7NO4 133.037507717 0.00012294 +mz_00004 76.03942694 HMDB03125 H2O2 34.005479308 0.00012494 +mz_00004 76.03942694 HMDB01039 HO 17.002739654 0.00012494 +mz_00004 76.03942694 HMDB00201 C9H17NO4 203.115758037 0.00041606 +mz_00004 76.03942694 HMDB31603 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB40214 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31681 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31174 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB38271 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31342 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31504 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB33793 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31593 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB39819 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB30330 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB29165 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31351 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB40591 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB32460 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB38962 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB32391 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31476 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31477 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB29314 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31500 C7H12O2 128.083729628 0.00068506 +mz_00004 76.03942694 HMDB31484 C7H12O2 128.083729628 0.00068506 +mz_00005 76.07584477 HMDB12136 C3H9NO 75.068413915 0.00015477 +mz_00005 76.07584477 HMDB00925 C3H9NO 75.068413915 0.00015477 +mz_00005 76.07584477 HMDB31652 C3H6O 58.041864814 0.00015677 +mz_00005 76.07584477 HMDB62143 C3H6O 58.041864813 0.00015677 +mz_00005 76.07584477 HMDB31558 C3H6O 58.041864814 0.00015677 +mz_00005 76.07584477 HMDB03366 C3H6O 58.041864814 0.00015677 +mz_00005 76.07584477 HMDB01659 C3H6O 58.041864814 0.00015677 +mz_00005 76.07584477 HMDB62061 C9H20 128.156500644 0.00065223 +mz_00005 76.07584477 HMDB31416 C9H20 128.15650064 0.00065223 +mz_00005 76.07584477 HMDB31556 C9H20 128.15650064 0.00065223 +mz_00005 76.07584477 HMDB30301 C9H20 128.15650064 0.00065223 +mz_00005 76.07584477 HMDB29595 C9H20 128.15650064 0.00065223 +mz_00005 76.07584477 HMDB30302 C9H20 128.15650064 0.00065223 +mz_00005 76.07584477 HMDB62013 C9H20 128.156500644 0.00065223 +mz_00005 76.07584477 HMDB62017 C9H20 128.156500644 0.00065223 +mz_00006 76.07593168 HMDB12136 C3H9NO 75.068413915 0.00024168 +mz_00006 76.07593168 HMDB00925 C3H9NO 75.068413915 0.00024168 +mz_00006 76.07593168 HMDB31652 C3H6O 58.041864814 0.00024368 +mz_00006 76.07593168 HMDB62143 C3H6O 58.041864813 0.00024368 +mz_00006 76.07593168 HMDB31558 C3H6O 58.041864814 0.00024368 +mz_00006 76.07593168 HMDB03366 C3H6O 58.041864814 0.00024368 +mz_00006 76.07593168 HMDB01659 C3H6O 58.041864814 0.00024368 +mz_00006 76.07593168 HMDB62061 C9H20 128.156500644 0.00056532 +mz_00006 76.07593168 HMDB31416 C9H20 128.15650064 0.00056532 +mz_00006 76.07593168 HMDB31556 C9H20 128.15650064 0.00056532 +mz_00006 76.07593168 HMDB30301 C9H20 128.15650064 0.00056532 +mz_00006 76.07593168 HMDB29595 C9H20 128.15650064 0.00056532 +mz_00006 76.07593168 HMDB30302 C9H20 128.15650064 0.00056532 +mz_00006 76.07593168 HMDB62013 C9H20 128.156500644 0.00056532 +mz_00006 76.07593168 HMDB62017 C9H20 128.156500644 0.00056532
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test02.html Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1 @@ +<?xml version="1.0" encoding="UTF-8" ?><!DOCTYPE html><html lang="en"><head><meta charset="utf-8"><meta name="viewport" content="width=device-width, initial-scale=1.0"><meta name="description" content=""><meta name="author" content="INRA de Clermont-Ferrand"><title>Galaxy HMDB queries - All results</title><link rel="stylesheet" type="text/css" href="css.php" media="all"><link rel="stylesheet" type="text/css" href="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/style/simplePagination.css"/><!-- JavaScript --><script src="https://ajax.googleapis.com/ajax/libs/jquery/1.7.2/jquery.min.js"></script><script src="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/scripts/jquery.simplePagination.js"></script><style type="text/css">body {padding-top: 70px}div.lm-table-warning { font-size: 1.4em; font-weight: bold; padding-right: 25px; color: #21536a; margin-left: 3px;}tr.green td {background-color: #eaf2d3; color: black;}tr.blank td {background-color: #9999CC; color: black;}table {font-family:'Trebuchet MS',Arial,Helvetica,sans-serif;width:100%;border-collapse:collapse;}table.detail, table.detail tr.parent, table.detail td, table.detail th, table.detail tr.category {border-collapse:collapse;border:1px solid #98bf21;}table.detail th {font-size: 1.2em;text-align: center;padding-top: 5px;padding-bottom: 10px;background-color: #a7c942;color: #ffffff;}td.ca {text-align:center;}footer { margin: 50px 0;}</style><script>function test(pageNumber){ var page="#page-id-"+pageNumber; $('.select').hide() ; $(page).show()}</script></head><body><div class="container"><div class="lm-table-warning">Results of HMDB queries - Search params : Molecular specie = positive / delta (mass-to-charge ratio) = 0.001</div><div id="detail_table_source" style="display:none"></div><p><div id="choose"></div><p><div id="ms_search_0" class="ms-search-table"></div><!-- HeadRows--><table id="detail_table" class="detail"><col style="width:30px;"><!-- Ids (m/z)--><col style="width:30px;"><!-- Mass (m/z)--><col style="width:30px;"><!-- Compound--><col style="width:120px;"><!-- name--><col style="width:40px;"><!-- adduct--><col style="width:50px;"><!-- adduct type--><col style="width:60px;"><!-- adduct mw--><col style="width:60px;"><!-- cpd mw--><col style="width:50px;"><!-- delta--><thead><th>ID from input</th><th>Mass (m/z)</th><th>Compound_ID</th><th>Formula</th><th>Compound MW (Da)</th><th>Adduct</th><th>Adduct_Type</th><th>Adduct MW (Da)</th><th>Delta</th></thead><tbody class="select" id="page-id-1"><tr class="white"><td class="ca" >mz_00001</td><td id="1" class="ca" >7.02080998</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/" target="_blank" class="btn">No_result_found_on_HMDB</a></td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">n/a</td><td class="ca">0</td></tr><tr class="green"><td class="ca" >mz_00002</td><td id="2" class="ca" >75.05547146</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31419" target="_blank" class="btn">HMDB31419</a></td><td class="ca">C2H6N2O</td><td class="ca">74.048012824</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.055289</td><td class="ca">0.00018246</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60428" target="_blank" class="btn">HMDB60428</a></td><td class="ca">C2H6N2O</td><td class="ca">74.048012824</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.055289</td><td class="ca">0.00018246</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00064" target="_blank" class="btn">HMDB00064</a></td><td class="ca">C4H9N3O2</td><td class="ca">131.069476547</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">75.055288</td><td class="ca">0.00018346</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13222" target="_blank" class="btn">HMDB13222</a></td><td class="ca">C4H9N3O2</td><td class="ca">131.069476547</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">75.055288</td><td class="ca">0.00018346</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32439" target="_blank" class="btn">HMDB32439</a></td><td class="ca">H3NO</td><td class="ca">33.021463723</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">75.055287</td><td class="ca">0.00018446</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03338" target="_blank" class="btn">HMDB03338</a></td><td class="ca">H3NO</td><td class="ca">33.021463723</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">75.055287</td><td class="ca">0.00018446</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13162" target="_blank" class="btn">HMDB13162</a></td><td class="ca">C11H22NO2</td><td class="ca">200.165053953</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">75.056275</td><td class="ca">0.00080354</td></tr><tr class="white"><td class="ca" >mz_00003</td><td id="3" class="ca" >75.08059797</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04327" target="_blank" class="btn">HMDB04327</a></td><td class="ca">C4H10O</td><td class="ca">74.073164942</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.080441</td><td class="ca">0.00015697</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62103" target="_blank" class="btn">HMDB62103</a></td><td class="ca">C4H10O</td><td class="ca">74.073164942</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.080441</td><td class="ca">0.00015697</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11469" target="_blank" class="btn">HMDB11469</a></td><td class="ca">C4H10O</td><td class="ca">74.073164942</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.080441</td><td class="ca">0.00015697</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06006" target="_blank" class="btn">HMDB06006</a></td><td class="ca">C4H10O</td><td class="ca">74.073164942</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.080441</td><td class="ca">0.00015697</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31456" target="_blank" class="btn">HMDB31456</a></td><td class="ca">C4H10O</td><td class="ca">74.073164942</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">75.080441</td><td class="ca">0.00015697</td></tr><tr class="green"><td class="ca" >mz_00004</td><td id="4" class="ca" >76.03942694</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00191" target="_blank" class="btn">HMDB00191</a></td><td class="ca">C4H7NO4</td><td class="ca">133.037507717</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31239" target="_blank" class="btn">HMDB31239</a></td><td class="ca">C2H5NO2</td><td class="ca">75.032028409</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00123" target="_blank" class="btn">HMDB00123</a></td><td class="ca">C2H5NO2</td><td class="ca">75.032028409</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14691" target="_blank" class="btn">HMDB14691</a></td><td class="ca">C2H5NO2</td><td class="ca">75.032028409</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11753" target="_blank" class="btn">HMDB11753</a></td><td class="ca">C4H7NO4</td><td class="ca">133.037507717</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06483" target="_blank" class="btn">HMDB06483</a></td><td class="ca">C4H7NO4</td><td class="ca">133.037507717</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">76.039304</td><td class="ca">0.00012294</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03125" target="_blank" class="btn">HMDB03125</a></td><td class="ca">H2O2</td><td class="ca">34.005479308</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">76.039302</td><td class="ca">0.00012494</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01039" target="_blank" class="btn">HMDB01039</a></td><td class="ca">HO</td><td class="ca">17.002739654</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">76.039302</td><td class="ca">0.00012494</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00201" target="_blank" class="btn">HMDB00201</a></td><td class="ca">C9H17NO4</td><td class="ca">203.115758037</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">76.039843</td><td class="ca">0.00041606</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31603" target="_blank" class="btn">HMDB31603</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40214" target="_blank" class="btn">HMDB40214</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31681" target="_blank" class="btn">HMDB31681</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31174" target="_blank" class="btn">HMDB31174</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38271" target="_blank" class="btn">HMDB38271</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31342" target="_blank" class="btn">HMDB31342</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31504" target="_blank" class="btn">HMDB31504</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33793" target="_blank" class="btn">HMDB33793</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31593" target="_blank" class="btn">HMDB31593</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39819" target="_blank" class="btn">HMDB39819</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30330" target="_blank" class="btn">HMDB30330</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29165" target="_blank" class="btn">HMDB29165</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31351" target="_blank" class="btn">HMDB31351</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40591" target="_blank" class="btn">HMDB40591</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32460" target="_blank" class="btn">HMDB32460</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38962" target="_blank" class="btn">HMDB38962</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32391" target="_blank" class="btn">HMDB32391</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31476" target="_blank" class="btn">HMDB31476</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31477" target="_blank" class="btn">HMDB31477</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29314" target="_blank" class="btn">HMDB29314</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31500" target="_blank" class="btn">HMDB31500</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31484" target="_blank" class="btn">HMDB31484</a></td><td class="ca">C7H12O2</td><td class="ca">128.083729628</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.040112</td><td class="ca">0.00068506</td></tr></tbody><tbody class="select" id="page-id-2"><tr class="white"><td class="ca" >mz_00005</td><td id="5" class="ca" >76.07584477</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12136" target="_blank" class="btn">HMDB12136</a></td><td class="ca">C3H9NO</td><td class="ca">75.068413915</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.07569</td><td class="ca">0.00015477</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00925" target="_blank" class="btn">HMDB00925</a></td><td class="ca">C3H9NO</td><td class="ca">75.068413915</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.07569</td><td class="ca">0.00015477</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31652" target="_blank" class="btn">HMDB31652</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00015677</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62143" target="_blank" class="btn">HMDB62143</a></td><td class="ca">C3H6O</td><td class="ca">58.041864813</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00015677</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31558" target="_blank" class="btn">HMDB31558</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00015677</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03366" target="_blank" class="btn">HMDB03366</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00015677</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01659" target="_blank" class="btn">HMDB01659</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00015677</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62061" target="_blank" class="btn">HMDB62061</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31416" target="_blank" class="btn">HMDB31416</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31556" target="_blank" class="btn">HMDB31556</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30301" target="_blank" class="btn">HMDB30301</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29595" target="_blank" class="btn">HMDB29595</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30302" target="_blank" class="btn">HMDB30302</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62013" target="_blank" class="btn">HMDB62013</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62017" target="_blank" class="btn">HMDB62017</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00065223</td></tr><tr class="green"><td class="ca" >mz_00006</td><td id="6" class="ca" >76.07593168</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12136" target="_blank" class="btn">HMDB12136</a></td><td class="ca">C3H9NO</td><td class="ca">75.068413915</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.07569</td><td class="ca">0.00024168</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00925" target="_blank" class="btn">HMDB00925</a></td><td class="ca">C3H9NO</td><td class="ca">75.068413915</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">76.07569</td><td class="ca">0.00024168</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31652" target="_blank" class="btn">HMDB31652</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00024368</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62143" target="_blank" class="btn">HMDB62143</a></td><td class="ca">C3H6O</td><td class="ca">58.041864813</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00024368</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31558" target="_blank" class="btn">HMDB31558</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00024368</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03366" target="_blank" class="btn">HMDB03366</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00024368</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01659" target="_blank" class="btn">HMDB01659</a></td><td class="ca">C3H6O</td><td class="ca">58.041864814</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">76.075688</td><td class="ca">0.00024368</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62061" target="_blank" class="btn">HMDB62061</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31416" target="_blank" class="btn">HMDB31416</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31556" target="_blank" class="btn">HMDB31556</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30301" target="_blank" class="btn">HMDB30301</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29595" target="_blank" class="btn">HMDB29595</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30302" target="_blank" class="btn">HMDB30302</a></td><td class="ca">C9H20</td><td class="ca">128.15650064</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62013" target="_blank" class="btn">HMDB62013</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62017" target="_blank" class="btn">HMDB62017</a></td><td class="ca">C9H20</td><td class="ca">128.156500644</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">76.076497</td><td class="ca">0.00056532</td></tr></tbody></table></div><div class="container"><hr><footer><div class="row"> <div class="col-lg-12"><p>Copyright © INRA, N Paulhe, F Giacomoni 2014 </p> </div> </div> </footer></div><script language="javascript">$(function() {$('#choose').pagination({items: 2,itemsOnPage: 1,currentPage: 1,onInit: function () { test(1); },cssStyle: 'light-theme',onPageClick: function(pageNumber){test(pageNumber)}}).pagination('redraw');});</script></body></html> \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test02.tsv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,7 @@ +id mz rt hmdb +1 7.02080998 49.38210915 No_result_found_on_HMDB +2 75.05547146 0.658528069 HMDB31419|HMDB60428|HMDB00064|HMDB13222|HMDB32439|HMDB03338|HMDB13162 +3 75.08059797 1743.94267 HMDB04327|HMDB62103|HMDB11469|HMDB06006|HMDB31456 +4 76.03942694 51.23158899 HMDB00191|HMDB31239|HMDB00123|HMDB14691|HMDB11753|HMDB06483|HMDB03125|HMDB01039|HMDB00201|HMDB31603|HMDB40214|HMDB31681|HMDB31174|HMDB38271|HMDB31342|HMDB31504|HMDB33793|HMDB31593|HMDB39819|HMDB30330|HMDB29165|HMDB31351|HMDB40591|HMDB32460|HMDB38962|HMDB32391|HMDB31476|HMDB31477|HMDB29314|HMDB31500|HMDB31484 +5 76.07584477 50.51249853 HMDB12136|HMDB00925|HMDB31652|HMDB62143|HMDB31558|HMDB03366|HMDB01659|HMDB62061|HMDB31416|HMDB31556|HMDB30301|HMDB29595|HMDB30302|HMDB62013|HMDB62017 +6 76.07593168 0.149308136 HMDB12136|HMDB00925|HMDB31652|HMDB62143|HMDB31558|HMDB03366|HMDB01659|HMDB62061|HMDB31416|HMDB31556|HMDB30301|HMDB29595|HMDB30302|HMDB62013|HMDB62017
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test03.csv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1116 @@ +ID MASS_SUBMIT HMDB_ID CPD_FORMULA CPD_MW DELTA +mz_00001 175.01 HMDB60293 H2O3S2 113.94453531 0.000125 +mz_00001 175.01 HMDB03745 C2H6O3S2 141.975835438 0.000676 +mz_00001 175.01 HMDB31436 H4O4Si 95.987885149 0.000895 +mz_00001 175.01 HMDB33657 C17H10O6 310.047738052 0.000914 +mz_00001 175.01 HMDB35230 C17H10O6 310.047738052 0.000914 +mz_00001 175.01 HMDB34155 CH4N2S 76.009518828 0.001744 +mz_00001 175.01 HMDB01570 C10H13N2O7P 304.046037292 0.002237 +mz_00001 175.01 HMDB01270 C3H8O10P2 265.9592695 0.003458 +mz_00001 175.01 HMDB01294 C3H8O10P2 265.9592695 0.003458 +mz_00001 175.01 HMDB60394 C9H12FN2O8P 326.031530087 0.004012 +mz_00001 175.01 HMDB60015 C6H6O4S 173.99867937 0.004045 +mz_00001 175.01 HMDB00021 C9H10INO3 306.970536611 0.004182 +mz_00001 175.01 HMDB15167 C5H4N4S 152.015666838 0.005115 +mz_00001 175.01 HMDB40364 C3H7MnO6P 224.936074104 0.005134 +mz_00001 175.01 HMDB62056 C6H7O4P 174.008195703 0.005472 +mz_00001 175.01 HMDB41485 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB00209 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB06853 C4H4O 68.02621475 0.005588 +mz_00001 175.01 HMDB03767 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB40733 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB38176 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33968 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB29635 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33128 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33766 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB40638 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32568 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB29686 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32603 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32400 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB31459 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB13785 C4H4O 68.02621475 0.005588 +mz_00001 175.01 HMDB02340 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB14912 C8H8F3N3O4S2 330.990831754 0.005966 +mz_00001 175.01 HMDB60764 C16H11ClN4O 310.062138701 0.006286 +mz_00001 175.01 HMDB40238 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB31370 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB37493 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB37787 C5H10N2 98.08439833 0.006562 +mz_00001 175.01 HMDB61807 C10H9Cl3O2 265.966812653 0.007229 +mz_00001 175.01 HMDB59985 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB59987 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB60020 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB14581 C5H4N4O 136.03851077 0.008331 +mz_00001 175.01 HMDB00157 C5H4N4O 136.03851077 0.008331 +mz_00001 175.01 HMDB40631 C15H12O7 304.058302738 0.008369 +mz_00001 175.01 HMDB31778 C14H9ClF2N2O2 310.032061659 0.008752 +mz_00001 175.01 HMDB31160 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB33053 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB33054 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB29694 C8H8OS 152.029585568 0.008804 +mz_00001 175.01 HMDB29783 C14H14O8 310.068867424 0.009651 +mz_00001 175.01 HMDB00613 C4H8O5 136.037173366 0.009669 +mz_00001 175.01 HMDB00943 C4H8O5 136.037173366 0.009669 +mz_00001 175.01 HMDB00115 C2H4O3 76.016043994 0.011306 +mz_00001 175.01 HMDB31608 C2H4O3 76.016043994 0.011306 +mz_00001 175.01 HMDB41797 C8H6Cl2O3 219.969399472 0.011761 +mz_00001 175.01 HMDB15413 C12H14N4O4S 310.073575646 0.012005 +mz_00001 175.01 HMDB15621 C12H14N4O4S 310.073575646 0.012005 +mz_00001 175.01 HMDB31825 C8H8S 136.034670946 0.012171 +mz_00001 175.01 HMDB31781 C14H15O2PS2 310.025107616 0.012229 +mz_00001 175.01 HMDB00634 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB00620 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB61185 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB00749 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB02092 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB33809 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB13233 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB59743 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB60365 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB60689 C4H11Cl2N2O2P 219.993519532 0.01236 +mz_00001 175.01 HMDB60691 C4H11Cl2N2O2P 219.993519532 0.01236 +mz_00001 175.01 HMDB00292 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB00786 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB01182 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB00072 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB00958 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB01264 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB61101 C11H10BrN5O 307.006872614 0.013986 +mz_00001 175.01 HMDB01520 C17H21N4O9P 456.104614802 0.01409 +mz_00001 175.01 HMDB37945 C23H20O10 456.10564686 0.014434 +mz_00001 175.01 HMDB39328 C23H20O10 456.10564686 0.014434 +mz_00001 175.01 HMDB40200 C7H10OS2 174.017306322 0.014582 +mz_00001 175.01 HMDB29614 C13H21O2PS2 304.072057808 0.015247 +mz_00001 175.01 HMDB32909 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB38322 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB41450 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB15176 C13H18Cl2N2O2 304.074533244 0.016485 +mz_00001 175.01 HMDB03152 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB33947 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB37819 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB30001 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB59711 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB40357 C18H14O5 310.084123558 0.017279 +mz_00001 175.01 HMDB03315 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31563 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB30332 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31564 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB33714 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB33549 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31498 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31497 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31196 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31496 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB35239 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB40264 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB40271 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62031 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62127 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62136 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61783 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61892 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61893 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61895 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61894 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB15679 C13H8Cl2N2O4 325.986112168 0.018697 +mz_00001 175.01 HMDB61135 C16H17ClN2S 304.080096951 0.019266 +mz_00001 175.01 HMDB29199 C14H14O9 326.063782046 0.020138 +mz_00001 175.01 HMDB12152 C9H17O12P 348.04576252 0.020157 +mz_00001 175.01 HMDB00175 C10H13N4O8P 348.047099924 0.020826 +mz_00001 175.01 HMDB11681 C10H13N4O8P 348.047099924 0.020826 +mz_00001 175.01 HMDB14684 C4H3FN2O2 130.017855555 0.020984 +mz_00001 175.01 HMDB39638 C9H6N2S 174.025168892 0.022445 +mz_00001 175.01 HMDB60086 C18H24N4O8S 456.131484454 0.023046 +mz_00001 175.01 HMDB14649 C12H9N3O5S 307.026291103 0.023696 +mz_00001 175.01 HMDB00695 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB00408 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB00491 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB01864 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB06024 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB10717 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33302 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33286 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31216 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31218 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33698 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31214 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB59876 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB12882 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB61881 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB59664 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB31188 C2H4OS 75.99828544 0.024211 +mz_00001 175.01 HMDB35716 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB33670 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB01067 C11H16N2O8 304.090665498 0.024551 +mz_00001 175.01 HMDB02818 C4H2N2O4 142.001456562 0.024946 +mz_00001 175.01 HMDB38442 C4H7NS2 133.001990609 0.025814 +mz_00001 175.01 HMDB00703 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB01101 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00020 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00440 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00669 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB02390 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB03791 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB04815 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB12308 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB30662 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB41507 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB36907 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32919 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB41283 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29657 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32606 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB34172 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB30745 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB32604 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29661 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29662 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32572 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32629 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB33003 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB41294 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB32594 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB31609 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29658 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29659 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB33866 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29660 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32399 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB38519 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29179 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29175 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29228 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29231 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB60390 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB62005 C8H8O3 152.047344118 0.026562 +mz_00001 175.01 HMDB11659 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB33919 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB31201 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB14805 C5H15N3O8P2 307.033437495 0.027269 +mz_00001 175.01 HMDB00973 HO4P 95.961245032 0.027535 +mz_00001 175.01 HMDB36343 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB33100 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB37570 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB30590 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB35880 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB30293 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB39958 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB01216 C6H8N4 136.074896276 0.028054 +mz_00001 175.01 HMDB01525 C3H4N2 68.037448138 0.028054 +mz_00001 175.01 HMDB30577 C10H6O3 174.031694058 0.02897 +mz_00001 175.01 HMDB30773 C10H6O3 174.031694058 0.02897 +mz_00001 175.01 HMDB59586 C8HF17O3S 499.937494073 0.029579 +mz_00001 175.01 HMDB32943 C12H21N2O3PS 304.10104975 0.029743 +mz_00001 175.01 HMDB33548 C5H6O2S 130.008850126 0.02999 +mz_00001 175.01 HMDB34073 C10H16N4O7 304.101898886 0.030167 +mz_00001 175.01 HMDB39723 C11H18O11 326.084911418 0.030703 +mz_00001 175.01 HMDB40737 C11H18O11 326.084911418 0.030703 +mz_00001 175.01 HMDB60455 C6H3ClO4 173.971986291 0.030738 +mz_00001 175.01 HMDB38263 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB37457 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB35462 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB38262 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB12916 CH2NO2S 91.980624003 0.030994 +mz_00001 175.01 HMDB11688 C5H12O11P2 309.98548425 0.032041 +mz_00001 175.01 HMDB38665 C15H16N2O5 304.105921632 0.032179 +mz_00001 175.01 HMDB61312 C15H14ClNO2S 307.043377094 0.032239 +mz_00001 175.01 HMDB37731 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB37762 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB29719 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB60503 C5H4O2 96.021129372 0.032349 +mz_00001 175.01 HMDB32914 C5H4O2 96.021129372 0.032349 +mz_00001 175.01 HMDB62029 C5H4O2 96.021129369 0.032349 +mz_00001 175.01 HMDB01059 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB01187 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB03848 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB04527 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB11741 C14H18N2O6 310.116486318 0.03346 +mz_00001 175.01 HMDB15140 CH4N2O2 76.027277382 0.033773 +mz_00001 175.01 HMDB34833 H8N2S 68.040818956 0.034796 +mz_00001 175.01 HMDB33956 C4H7Cl2O4P 219.945900638 0.035259 +mz_00001 175.01 HMDB29396 C5H10N2O2 130.074227574 0.035388 +mz_00001 175.01 HMDB30405 C5H10N2O2 130.074227574 0.035388 +mz_00001 175.01 HMDB36635 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB41298 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB33310 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB31744 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB00839 C20H14N4 310.121846468 0.03614 +mz_00001 175.01 HMDB39926 C22H28O11S 500.135232428 0.036334 +mz_00001 175.01 HMDB01448 O4S 95.951729178 0.037051 +mz_00001 175.01 HMDB15102 C19H19ClN2 310.123676325 0.037055 +mz_00001 175.01 HMDB04230 C5H5NO2 111.032028409 0.037793 +mz_00001 175.01 HMDB38175 C5H5NO2 111.032028409 0.037793 +mz_00001 175.01 HMDB04194 C7H8N2O2 152.05857751 0.037796 +mz_00001 175.01 HMDB04193 C7H8N2O2 152.05857751 0.037796 +mz_00001 175.01 HMDB33581 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39509 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39167 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39169 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36936 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36735 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB60077 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36981 C25H28O8 456.178417872 0.038691 +mz_00001 175.01 HMDB01202 C9H14N3O7P 307.056936329 0.039018 +mz_00001 175.01 HMDB60488 CH4Se 95.947821956 0.040958 +mz_00001 175.01 HMDB30879 C2H6SSe 141.93554271 0.040968 +mz_00001 175.01 HMDB03638 Cd 113.903358121 0.041302 +mz_00001 175.01 HMDB14694 C15H13N3O4S 331.062676609 0.041888 +mz_00001 175.01 HMDB34416 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB37290 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB31470 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB31628 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB34378 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31627 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB33962 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31312 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38985 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32621 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38988 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32624 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38986 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB39782 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB29667 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32625 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32149 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32029 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38987 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38984 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32544 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31446 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32441 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB59896 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB34894 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB38696 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB33909 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB31537 C7H14S 130.081621138 0.042781 +mz_00001 175.01 HMDB02332 C3H4O5S 151.977943928 0.042838 +mz_00001 175.01 HMDB60768 C4H6N2O 98.048012824 0.042947 +mz_00001 175.01 HMDB37336 C24H26O13 522.137340918 0.043056 +mz_00001 175.01 HMDB33705 C24H26O13 522.137340918 0.043056 +mz_00001 175.01 HMDB62164 C4H7NO2S 133.019749643 0.043573 +mz_00001 175.01 HMDB12236 C6H9N2O5P 220.02490792 0.043748 +mz_00001 175.01 HMDB39123 C14H18N2O7 326.11140094 0.043947 +mz_00001 175.01 HMDB14843 C22H28N6O3S 456.194359482 0.044004 +mz_00001 175.01 HMDB39777 C28H24N2O7 500.158351132 0.04404 +mz_00001 175.01 HMDB00905 C10H14N5O6P 331.068169717 0.044635 +mz_00001 175.01 HMDB37494 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB35790 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB29305 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB32956 C12H10O7 266.042652674 0.045149 +mz_00001 175.01 HMDB32746 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32747 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32744 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32745 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB34015 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB30606 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB30605 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40315 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40313 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB41299 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40930 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB34279 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB00508 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB00568 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB01851 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB02917 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB33730 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB39788 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB39787 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB31853 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB32939 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB14118 C2HF3O2 113.992863891 0.048204 +mz_00001 175.01 HMDB31238 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB31634 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB34238 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB15583 C22H18N2 310.146998586 0.048716 +mz_00001 175.01 HMDB06590 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB06701 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB29523 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB40154 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB00630 C4H5N3O 111.043261797 0.049027 +mz_00001 175.01 HMDB14021 C19H19FN2O 310.148141445 0.049288 +mz_00001 175.01 HMDB60576 C19H19FN2O 310.148141445 0.049288 +mz_00001 175.01 HMDB03826 C13H18N4O6 326.122634328 0.049564 +mz_00002 238.19 HMDB04043 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36086 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB04472 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB05812 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35861 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB38025 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37049 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB31410 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB41034 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35815 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35819 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36126 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36112 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37047 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36196 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35955 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36068 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34976 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35818 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36077 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37019 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34848 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35820 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35842 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35954 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37016 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35783 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35825 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37048 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36096 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37133 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36097 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36993 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36991 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37007 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35841 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB32118 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36100 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37006 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35823 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37161 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37215 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB41014 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35155 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36996 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB30999 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36101 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36102 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36107 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36041 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34972 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB40448 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37214 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34969 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36078 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB38185 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35838 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35162 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34932 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35272 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35833 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB32530 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59881 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59864 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59869 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB61802 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB01422 C9H21N2O3 205.155217548 0.001293 +mz_00002 238.19 HMDB30326 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB31179 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB39833 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB39834 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB14888 C13H20N2O 220.157563272 0.001386 +mz_00002 238.19 HMDB14362 C10H15N3 177.126597495 0.001937 +mz_00002 238.19 HMDB30898 C28H40O 392.307915902 0.002219 +mz_00002 238.19 HMDB40385 C39H41NO9 667.278131915 0.002234 +mz_00002 238.19 HMDB39692 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34644 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34683 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34505 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB35326 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34528 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB15415 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB28890 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB28953 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB41845 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB12189 C8H21N3 159.173547687 0.004768 +mz_00002 238.19 HMDB31506 C8H21N3 159.173547687 0.004768 +mz_00002 238.19 HMDB34814 C30H54O 430.41746635 0.007951 +mz_00002 238.19 HMDB04437 C4H11NO2 105.078978601 0.008923 +mz_00002 238.19 HMDB34839 C31H48O2 452.36543078 0.009038 +mz_00002 238.19 HMDB60502 C31H48O2 452.36543078 0.009038 +mz_00002 238.19 HMDB35234 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB37327 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB35536 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB35537 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB37328 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB14968 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40017 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB39667 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB33484 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB39664 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40018 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40020 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40027 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40014 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40019 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB41923 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB30273 C28H46N2O4 474.34575797 0.009845 +mz_00002 238.19 HMDB00698 C26H43NO4 433.319208869 0.009846 +mz_00002 238.19 HMDB15072 C13H19NO 205.146664235 0.009847 +mz_00002 238.19 HMDB00946 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB03315 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB00348 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00361 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00384 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00411 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00438 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00478 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00514 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00518 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00626 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00664 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00686 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00733 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00811 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02451 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02488 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02536 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02585 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB32901 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31692 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31030 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB36599 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB34903 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB39539 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB38996 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB37606 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB31563 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB38280 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB41469 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB30332 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB32193 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40277 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB35157 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB36389 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40206 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31564 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB29728 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40217 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40226 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB30867 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB38270 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB30945 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB33714 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB33549 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31498 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31497 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31196 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB39522 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40725 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB13817 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB29721 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB37718 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB31496 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31541 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB36048 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40397 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB32051 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB35239 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB41494 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40264 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB37714 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40278 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40227 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB37301 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB61891 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40271 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB32331 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB62144 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB60843 C13H19NO 205.146664235 0.009847 +mz_00002 238.19 HMDB61816 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB62031 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB62127 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB07895 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB08917 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB11203 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB11370 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB13402 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB13403 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB01893 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB12171 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB30022 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB59642 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB37163 C11H24O4 220.167459256 0.011282 +mz_00002 238.19 HMDB30083 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB37639 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB40267 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB61936 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB37787 C5H10N2 98.08439833 0.01262 +mz_00002 238.19 HMDB01009 C11H17N2 177.139173554 0.014514 +mz_00002 238.19 HMDB35144 C29H46O5 474.334524582 0.015462 +mz_00002 238.19 HMDB35221 C29H46O5 474.334524582 0.015462 +mz_00002 238.19 HMDB00483 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00513 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00556 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00558 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB02180 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB02208 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB60994 C15H25NO4 283.178358293 0.017198 +mz_00002 238.19 HMDB39019 C27H36O2 392.271530396 0.020412 +mz_00002 238.19 HMDB08838 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08839 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08870 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08869 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08931 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08963 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08962 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09122 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09155 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09187 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09317 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09350 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09382 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09415 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB07901 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB07933 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB08827 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08828 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08859 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB08924 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08956 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08987 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB09019 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB09052 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB15050 C10H15N5 205.132745505 0.023765 +mz_00002 238.19 HMDB35360 C7H15NO4 177.100107973 0.024552 +mz_00002 238.19 HMDB29936 C9H20NO2 174.149403889 0.024831 +mz_00002 238.19 HMDB13223 C9H20NO2 174.149403889 0.024831 +mz_00002 238.19 HMDB04231 C9H19NO4 205.131408101 0.025103 +mz_00002 238.19 HMDB35645 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37395 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35720 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB39711 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36118 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35306 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34940 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB30232 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36793 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35097 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36789 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35020 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB41490 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB40763 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38209 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB33826 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38123 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38134 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB39532 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35718 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38193 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36717 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38208 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36788 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38160 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35704 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37069 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35026 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35793 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38212 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35739 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38146 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36420 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36798 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36402 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36192 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38119 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37275 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB38982 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37392 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB60356 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34718 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34661 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38211 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB41404 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB36716 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38512 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35391 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36172 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB38210 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB32220 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB32247 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB37811 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB13688 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB59836 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB60295 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB00520 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB00524 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB00655 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB01231 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB01968 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB29851 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB35888 C30H44O3 452.329045274 0.02723 +mz_00002 238.19 HMDB37065 C30H44O3 452.329045274 0.02723 +mz_00002 238.19 HMDB29993 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB30296 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB32868 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB60730 C23H36O5 392.256274262 0.02804 +mz_00002 238.19 HMDB12166 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB37914 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB38353 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB35513 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB10701 C36H72NO6P 645.509725553 0.030873 +mz_00002 238.19 HMDB38163 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB32564 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB38162 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB14647 C19H25NO 283.193614427 0.032454 +mz_00002 238.19 HMDB13972 C19H25NO 283.193614427 0.032454 +mz_00002 238.19 HMDB28799 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB29151 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB28883 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB28899 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB15508 C15H21N 215.167399677 0.033382 +mz_00002 238.19 HMDB36683 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB59826 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB59696 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB61824 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB30085 C28H42O6 474.298139076 0.033654 +mz_00002 238.19 HMDB60061 C16H34NO5P 351.217459715 0.034173 +mz_00002 238.19 HMDB41940 C9H11N3O 177.090211989 0.034448 +mz_00002 238.19 HMDB29741 C10H16N2O2 196.121177766 0.034999 +mz_00002 238.19 HMDB40551 C10H16N2O2 196.121177766 0.034999 +mz_00002 238.19 HMDB30353 C8H13NO2 155.094628665 0.035001 +mz_00002 238.19 HMDB62098 C8H13NO2 155.094628663 0.035001 +mz_00002 238.19 HMDB31659 C5H13N 87.104799421 0.035364 +mz_00002 238.19 HMDB32392 C5H13N 87.104799421 0.035364 +mz_00002 238.19 HMDB31202 C12H29N3 215.236147943 0.035366 +mz_00002 238.19 HMDB35135 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB38697 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB38268 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB31302 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB37276 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB36177 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB36239 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB40285 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB32314 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB32442 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB60285 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB29888 C24H46O6 430.329439204 0.036062 +mz_00002 238.19 HMDB29551 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB31205 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB61812 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB62070 C11H22 154.172150708 0.037261 +mz_00002 238.19 HMDB60817 C10H21N3O2 215.163376931 0.037405 +mz_00002 238.19 HMDB33870 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB01080 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB60247 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB31581 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB31215 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB13287 C8H18N2O2 174.13682783 0.037407 +mz_00002 238.19 HMDB04649 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB35983 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB30395 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB15659 C10H21N 155.167399677 0.03777 +mz_00002 238.19 HMDB32350 C10H21N 155.167399677 0.03777 +mz_00002 238.19 HMDB29987 C30H60O2 452.459331164 0.037913 +mz_00002 238.19 HMDB30925 C30H60O2 452.459331164 0.037913 +mz_00002 238.19 HMDB31977 C26H32O3 392.23514489 0.038605 +mz_00002 238.19 HMDB35640 C31H42O 430.323565966 0.038999 +mz_00002 238.19 HMDB07003 C19H37O6P 392.232775428 0.039789 +mz_00002 238.19 HMDB02372 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB03563 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB30191 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB39521 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB34669 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB32845 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB14592 C19H29NO5 351.204573043 0.040616 +mz_00002 238.19 HMDB35472 C44H89NO5 711.674074963 0.041968 +mz_00002 238.19 HMDB14375 C8H17NO2 159.125928793 0.042851 +mz_00002 238.19 HMDB00991 C8H17NO2 159.125928793 0.042851 +mz_00002 238.19 HMDB59796 C29H57N5O12 667.400372313 0.042981 +mz_00002 238.19 HMDB08883 C35H68NO7P 645.473340047 0.043002 +mz_00002 238.19 HMDB11336 C35H68NO7P 645.473340047 0.043002 +mz_00002 238.19 HMDB12501 C23H39NO6S 457.249808675 0.044546 +mz_00002 238.19 HMDB29802 C27H52O 392.401816286 0.044731 +mz_00002 238.19 HMDB14354 C25H30NO3 392.222568831 0.044893 +mz_00002 238.19 HMDB02195 C26H44O5 436.318874518 0.045346 +mz_00002 238.19 HMDB30092 C31H64 436.500802048 0.045618 +mz_00002 238.19 HMDB01855 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB33482 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB37693 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB40045 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB12490 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB60063 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB40046 C12H15NO2 205.110278729 0.046232 +mz_00002 238.19 HMDB32589 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB36226 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB37734 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB37492 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB40424 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB34662 C22H32O6 392.219888756 0.046233 +mz_00002 238.19 HMDB37725 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB61823 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB61942 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB11560 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB11590 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB12458 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB34403 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB36249 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB30066 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB60127 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB60128 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB13279 C11H21NO3 215.152143543 0.048638 +mz_00002 238.19 HMDB34040 C9H18O3 174.125594442 0.048641 +mz_00002 238.19 HMDB31513 C9H18O3 174.125594442 0.048641 +mz_00002 238.19 HMDB41818 C16H14FN3O 283.11209029 0.04907 +mz_00002 238.19 HMDB12271 C5H11N3O4 177.074955855 0.049704 +mz_00003 420.16 HMDB60836 C17H17N3O4S 359.093976737 0.000683 +mz_00003 420.16 HMDB60838 C17H17N3O4S 359.093976737 0.000683 +mz_00003 420.16 HMDB33374 C16H19NO5S 337.098393413 0.001237 +mz_00003 420.16 HMDB00590 C7H11NO5 189.063722467 0.001268 +mz_00003 420.16 HMDB01138 C7H11NO5 189.063722467 0.001268 +mz_00003 420.16 HMDB14535 C15H23N3O4S 341.140926929 0.002147 +mz_00003 420.16 HMDB15135 C15H23N3O4S 341.140926929 0.002147 +mz_00003 420.16 HMDB30384 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB36989 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB30189 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB40341 C34H44O19 756.247679226 0.002337 +mz_00003 420.16 HMDB40372 C34H44O19 756.247679226 0.002337 +mz_00003 420.16 HMDB31695 C17H24O8 356.147117744 0.002883 +mz_00003 420.16 HMDB40558 C17H24O8 356.147117744 0.002883 +mz_00003 420.16 HMDB31574 C8H15NS2 189.064590865 0.003005 +mz_00003 420.16 HMDB32499 C8H15NS2 189.064590865 0.003005 +mz_00003 420.16 HMDB15253 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB01267 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB04145 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB04146 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB41452 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29533 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB30141 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB34027 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB30450 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB37922 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29791 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29787 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB34050 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB04662 C11H19N3O7S 337.094370667 0.005259 +mz_00003 420.16 HMDB39733 C11H19N3O7S 337.094370667 0.005259 +mz_00003 420.16 HMDB31401 C20H21NO7 387.131802031 0.005291 +mz_00003 420.16 HMDB35415 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB39137 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB35037 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB29308 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB37755 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB39379 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB29540 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB29304 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB33211 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB39157 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB29286 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB06591 C12H23NO10 341.132195961 0.006584 +mz_00003 420.16 HMDB11668 C12H23NO10 341.132195961 0.006584 +mz_00003 420.16 HMDB33395 C39H50O20 838.28954404 0.007952 +mz_00003 420.16 HMDB32864 C16H23NO7 341.147452095 0.008672 +mz_00003 420.16 HMDB30934 C14H17NO10 359.085245769 0.009414 +mz_00003 420.16 HMDB14502 C17H16F6N2O 378.116682374 0.009495 +mz_00003 420.16 HMDB37265 C16H21NO10 387.116545897 0.009965 +mz_00003 420.16 HMDB37262 C16H21NO10 387.116545897 0.009965 +mz_00003 420.16 HMDB59971 C17H22O11 402.116211546 0.009965 +mz_00003 420.16 HMDB59973 C17H22O11 402.116211546 0.009965 +mz_00003 420.16 HMDB28896 C17H19N5O3 341.148789499 0.010009 +mz_00003 420.16 HMDB29085 C17H19N5O3 341.148789499 0.010009 +mz_00003 420.16 HMDB00434 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB40256 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB35721 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB30571 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB29648 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB37177 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB29645 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB39427 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB40637 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB32365 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB62121 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60398 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60733 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60735 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB11739 C12H26O13 378.137340918 0.011164 +mz_00003 420.16 HMDB33927 C12H20N2O9 336.116880248 0.01199 +mz_00003 420.16 HMDB33187 C14H10 178.07825032 0.012266 +mz_00003 420.16 HMDB33558 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB35321 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB41487 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB39475 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB29326 C19H19NO5 341.126322723 0.012457 +mz_00003 420.16 HMDB33366 C19H19NO5 341.126322723 0.012457 +mz_00003 420.16 HMDB14668 C20H29N3O2 343.225977187 0.014983 +mz_00003 420.16 HMDB41441 C22H18O6 378.110338308 0.015839 +mz_00003 420.16 HMDB31182 C16H19NO7 337.116151967 0.016522 +mz_00003 420.16 HMDB61008 C10H13ClN2 196.076726133 0.016572 +mz_00003 420.16 HMDB42015 C21H26N2O2S2 402.143569466 0.017392 +mz_00003 420.16 HMDB01857 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB01982 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB02026 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB04308 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB11103 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB59704 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB30328 C19H27NO7 381.178752223 0.01809 +mz_00003 420.16 HMDB41401 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30333 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB33879 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB33880 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30798 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB35403 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30666 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB35440 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30435 C22H23NO6 397.152537473 0.018245 +mz_00003 420.16 HMDB02040 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB41290 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB38774 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB38965 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB29459 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB31055 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB38712 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB35525 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB39471 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB34213 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB41123 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB30682 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB33027 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB30903 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB33248 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB03409 C20H18NO4 336.123583069 0.018693 +mz_00003 420.16 HMDB61059 C19H22ClN5O2 387.14620268 0.019692 +mz_00003 420.16 HMDB61060 C19H22ClN5O2 387.14620268 0.019692 +mz_00003 420.16 HMDB11658 C15H15NO8 337.079766461 0.019864 +mz_00003 420.16 HMDB13189 C15H15NO8 337.079766461 0.019864 +mz_00003 420.16 HMDB00565 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB00625 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB03290 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB29287 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB29288 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33999 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB30654 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33997 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33563 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB34396 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40543 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB39951 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB41470 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38253 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38470 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37427 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB35004 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37959 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38768 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37566 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40294 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37353 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37411 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40350 C23H22O5 378.146723814 0.020547 +mz_00003 420.16 HMDB30656 C23H22O5 378.146723814 0.020547 +mz_00003 420.16 HMDB61313 C21H20ClFNO 356.121745179 0.02249 +mz_00003 420.16 HMDB60562 C12H20N2O5S2 336.08136314 0.023527 +mz_00003 420.16 HMDB29419 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB28731 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB28836 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB31791 C25H22ClNO3 419.128821282 0.023903 +mz_00003 420.16 HMDB14842 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB30184 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB31998 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB33789 C7H14O5 178.084123558 0.024012 +mz_00003 420.16 HMDB15264 C19H20N2O3S 356.119463206 0.024772 +mz_00003 420.16 HMDB14828 C21H23ClFN3O 387.151368285 0.024857 +mz_00003 420.16 HMDB29569 C8H18S2 178.084991956 0.025749 +mz_00003 420.16 HMDB40348 C8H18S2 178.084991956 0.025749 +mz_00003 420.16 HMDB15540 C21H27N3O7S 465.156970923 0.025811 +mz_00003 420.16 HMDB30340 C21H29NO3 343.214743799 0.026216 +mz_00003 420.16 HMDB33959 C21H29NO3 343.214743799 0.026216 +mz_00003 420.16 HMDB41190 C18H26O10 402.152597052 0.02642 +mz_00003 420.16 HMDB41514 C18H26O10 402.152597052 0.02642 +mz_00003 420.16 HMDB01260 C21H35N9O15P2 715.172784519 0.026511 +mz_00003 420.16 HMDB10336 C15H21NO9 359.121631275 0.026971 +mz_00003 420.16 HMDB29452 C15H21NO9 359.121631275 0.026971 +mz_00003 420.16 HMDB33107 C16H20N2O6 336.132136382 0.027246 +mz_00003 420.16 HMDB37997 C21H21O12 465.103301136 0.027859 +mz_00003 420.16 HMDB15576 C6H12N3PS 189.048954601 0.028268 +mz_00003 420.16 HMDB61129 C17H17ClO5 336.076451361 0.028439 +mz_00003 420.16 HMDB31826 C39H62NO16 800.406859941 0.028647 +mz_00003 420.16 HMDB15178 C19H22FN3O4 375.159434412 0.029406 +mz_00003 420.16 HMDB04645 C10H16N4O7S 336.073969576 0.03092 +mz_00003 420.16 HMDB41257 C20H18O9 402.095082174 0.031095 +mz_00003 420.16 HMDB39332 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB37437 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB32910 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB39609 C21H20O4 336.136159128 0.031269 +mz_00003 420.16 HMDB35501 C21H20O4 336.136159128 0.031269 +mz_00003 420.16 HMDB02250 C19H37NO4 343.272258677 0.031299 +mz_00003 420.16 HMDB29332 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB33524 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB29827 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB14970 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB02302 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB29738 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB12201 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB12202 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB12203 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB41369 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB32000 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB37688 C9H12N2O3 196.08479226 0.032705 +mz_00003 420.16 HMDB32852 C9H12N2O3 196.08479226 0.032705 +mz_00003 420.16 HMDB33965 C15H27NO10 381.163496089 0.033346 +mz_00003 420.16 HMDB40866 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB36938 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB40664 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB31025 C41H62O15 794.408871314 0.033654 +mz_00003 420.16 HMDB01162 C49H58FeN4O5 838.375663119 0.035108 +mz_00003 420.16 HMDB32382 C19H23N3O3 341.173941617 0.035162 +mz_00003 420.16 HMDB05026 C18H21N3O3S 359.130362243 0.035702 +mz_00003 420.16 HMDB30394 C16H25NO9 375.152931403 0.035909 +mz_00003 420.16 HMDB15107 C22H24ClN3O 381.160790112 0.036052 +mz_00003 420.16 HMDB14717 C17H18N2O6S 378.088557008 0.03762 +mz_00003 420.16 HMDB38228 C13H23NO9 337.137281339 0.037651 +mz_00003 420.16 HMDB12286 C8H15NO2S 189.082349419 0.038522 +mz_00003 420.16 HMDB61100 C14H19N5O5 337.138618743 0.038989 +mz_00003 420.16 HMDB01117 C12H23N2O9PS 402.086187546 0.039989 +mz_00003 420.16 HMDB41986 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB61220 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB61221 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB59631 C14H12O 196.088815006 0.04075 +mz_00003 420.16 HMDB00715 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB60331 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB60332 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB14411 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34129 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34039 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34049 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB37373 C39H32O16 756.169034976 0.04166 +mz_00003 420.16 HMDB41231 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB36900 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB41349 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB35053 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB41002 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB34474 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB30657 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB29542 C22H26O7 402.167853186 0.041676 +mz_00003 420.16 HMDB36694 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB36945 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB34016 C22H26O7 402.167853186 0.041676 +mz_00003 420.16 HMDB36897 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB60871 C44H55NO14 821.362255473 0.041678 +mz_00003 420.16 HMDB60870 C44H55NO14 821.362255473 0.041678 +mz_00003 420.16 HMDB33356 C21H26NO4 356.186183325 0.041948 +mz_00003 420.16 HMDB41519 C20H20N2O3 336.147392516 0.042503 +mz_00003 420.16 HMDB01132 C11H16NO9P 337.056267627 0.043362 +mz_00003 420.16 HMDB14739 C16H20FN3O4 337.143784348 0.044154 +mz_00003 420.16 HMDB59612 C11H17N5O8P 378.081474057 0.044703 +mz_00003 420.16 HMDB31833 C17H14ClN3O2S 359.049525104 0.045135 +mz_00003 420.16 HMDB13929 C16H16ClNO3S 337.05394178 0.045688 +mz_00003 420.16 HMDB29684 C7H6N4O2 178.049075456 0.046084 +mz_00003 420.16 HMDB39318 C42H62O17 838.398700558 0.046626 +mz_00003 420.16 HMDB31714 C7H14OS2 178.04860645 0.047022 +mz_00003 420.16 HMDB60667 C24H25NO 343.193614427 0.047346 +mz_00003 420.16 HMDB61086 C24H25NO 343.193614427 0.047346 +mz_00003 420.16 HMDB40241 C11H16OS 196.092185824 0.047492 +mz_00003 420.16 HMDB41088 C26H27NO7 465.178752223 0.047592 +mz_00003 420.16 HMDB01956 C40H40N4O14 800.254102008 0.047732 +mz_00003 420.16 HMDB60775 C16H13ClFNO4 337.051713821 0.047916 +mz_00003 420.16 HMDB61718 C21H28N2OS 356.192234218 0.047999 +mz_00003 420.16 HMDB14645 C21H23ClFNO2 375.140134897 0.048705 +mz_00003 420.16 HMDB00150 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB01353 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB01385 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB02541 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB03466 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB39724 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB39726 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB29938 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB39722 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB29932 C6H10O6 178.047738052 0.048759 +mz_00004 780.32 HMDB31947 C17H23NO8 369.142366717 0.001444 +mz_00004 780.32 HMDB35940 C44H44O9 716.298533006 0.005702 +mz_00004 780.32 HMDB33906 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB39032 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB32731 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB39575 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB32105 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB35108 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB30081 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB36780 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB15535 C16H26N2O5S 358.156242642 0.00825 +mz_00004 780.32 HMDB33715 C68H112O37 1520.688244598 0.009339 +mz_00004 780.32 HMDB14038 C21H20FNO4 369.137636338 0.010904 +mz_00004 780.32 HMDB38999 C17H26O6S 358.145009254 0.014216 +mz_00004 780.32 HMDB00244 C17H20N4O6 376.138284392 0.020311 +mz_00004 780.32 HMDB35698 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB35467 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB38113 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB41276 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB30573 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB30709 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB35789 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB36837 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB40600 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB33300 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB33301 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB06676 C54H89N3O41 1435.497149365 0.024328 +mz_00004 780.32 HMDB01069 C16H18N6O4 358.138953094 0.026329 +mz_00004 780.32 HMDB33084 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB36765 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB61331 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB38971 C19H24N2O6 376.16343651 0.029993 +mz_00004 780.32 HMDB00768 C14H23NO11 381.127110583 0.031956 +mz_00004 780.32 HMDB33932 C23H20O5 376.13107375 0.034732 +mz_00004 780.32 HMDB38229 C37H40N4O11 716.269358142 0.034877 +mz_00004 780.32 HMDB15107 C22H24ClN3O 381.160790112 0.035403 +mz_00004 780.32 HMDB29788 C24H24O4 376.167459256 0.038039 +mz_00004 780.32 HMDB29299 C32H40O17 696.226549854 0.03834 +mz_00004 780.32 HMDB61254 C38H41N3O11S 747.246179859 0.040331 +mz_00004 780.32 HMDB61256 C38H41N3O11S 747.246179859 0.040331 +mz_00004 780.32 HMDB33965 C15H27NO10 381.163496089 0.040815 +mz_00004 780.32 HMDB12364 C36H66NO10P 703.442433849 0.041474 +mz_00004 780.32 HMDB12344 C36H66NO10P 703.442433849 0.041474 +mz_00004 780.32 HMDB06606 C29H49NO23 779.269536879 0.043187 +mz_00004 780.32 HMDB13001 C54H92O46 1476.485975556 0.043189 +mz_00004 780.32 HMDB12201 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB41369 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB12202 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB12203 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB32000 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB29401 C20H19NO6 369.121237345 0.043702 +mz_00004 780.32 HMDB33522 C21H19NO6 381.121237345 0.043702 +mz_00004 780.32 HMDB29360 C20H19NO6 369.121237345 0.043702 +mz_00005 956.25 HMDB35451 C43H49O23 933.266462874 0.005681 +mz_00005 956.25 HMDB38095 C43H49O23 933.266462874 0.005681 +mz_00005 956.25 HMDB40803 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB02219 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB38821 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB40511 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB34149 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB33990 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB35931 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB29617 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB36630 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB41455 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB60157 C30H52N7O18P3S 923.230238121 0.013727 +mz_00005 956.25 HMDB33021 C43H49O22 917.271548252 0.015294 +mz_00005 956.25 HMDB41153 C40H41O22 873.208947996 0.019318 +mz_00005 956.25 HMDB60375 C35H54N7O19P3S 1001.240802807 0.019643 +mz_00005 956.25 HMDB35163 C40H42O26 938.196431516 0.019745 +mz_00005 956.25 HMDB29794 C40H42O26 938.196431516 0.019745 +mz_00005 956.25 HMDB04047 C27H44N7O19P3S 895.162552487 0.022108 +mz_00005 956.25 HMDB40378 C45H38O21 914.190558278 0.025619 +mz_00005 956.25 HMDB14756 C21H21ClN2O8 464.098643365 0.029593 +mz_00005 956.25 HMDB12207 C28H42N7O17P3S 873.157073179 0.032557 +mz_00005 956.25 HMDB35883 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB37932 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB34725 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB33132 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB40478 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB34360 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB37362 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB30775 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB30747 C22H24O11 464.13186161 0.036843 +mz_00005 956.25 HMDB37535 C22H24O11 464.13186161 0.036843 +mz_00005 956.25 HMDB14927 C28H54GdN5O20 938.260314726 0.044138 +mz_00006 1100.45 HMDB60499 C28H30N4O6 518.216534712 0.001166 +mz_00006 1100.45 HMDB32198 C30H34Cl2N4O 536.210967144 0.004946 +mz_00006 1100.45 HMDB06568 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB02060 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB06582 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB10345 C27H36O11 536.225761994 0.024644 +mz_00006 1100.45 HMDB36888 C27H36O11 536.225761994 0.024644 +mz_00006 1100.45 HMDB39422 C48H64N11O18 1082.443079299 0.026902 +mz_00006 1100.45 HMDB35520 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB38923 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB29773 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB15455 C53H67N9O10S 1021.473160099 0.04438 +mz_00006 1100.45 HMDB40723 C30H30O8 518.194067936 0.046099 +mz_00006 1100.45 HMDB01980 C46H65N13O12S2 1055.431705989 0.047134 +mz_00006 1100.45 HMDB33282 C26H32O12 536.189376488 0.048127 +mz_00006 1100.45 HMDB33281 C26H32O12 536.189376488 0.048127 +mz_00006 1100.45 HMDB15595 C28H22F3N7O 529.183792976 0.048591
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test03.html Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1 @@ +<?xml version="1.0" encoding="UTF-8" ?><!DOCTYPE html><html lang="en"><head><meta charset="utf-8"><meta name="viewport" content="width=device-width, initial-scale=1.0"><meta name="description" content=""><meta name="author" content="INRA de Clermont-Ferrand"><title>Galaxy HMDB queries - All results</title><link rel="stylesheet" type="text/css" href="css.php" media="all"><link rel="stylesheet" type="text/css" href="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/style/simplePagination.css"/><!-- JavaScript --><script src="https://ajax.googleapis.com/ajax/libs/jquery/1.7.2/jquery.min.js"></script><script src="https://cdn.rawgit.com/fgiacomoni/galaxy_utils/master/scripts/jquery.simplePagination.js"></script><style type="text/css">body {padding-top: 70px}div.lm-table-warning { font-size: 1.4em; font-weight: bold; padding-right: 25px; color: #21536a; margin-left: 3px;}tr.green td {background-color: #eaf2d3; color: black;}tr.blank td {background-color: #9999CC; color: black;}table {font-family:'Trebuchet MS',Arial,Helvetica,sans-serif;width:100%;border-collapse:collapse;}table.detail, table.detail tr.parent, table.detail td, table.detail th, table.detail tr.category {border-collapse:collapse;border:1px solid #98bf21;}table.detail th {font-size: 1.2em;text-align: center;padding-top: 5px;padding-bottom: 10px;background-color: #a7c942;color: #ffffff;}td.ca {text-align:center;}footer { margin: 50px 0;}</style><script>function test(pageNumber){ var page="#page-id-"+pageNumber; $('.select').hide() ; $(page).show()}</script></head><body><div class="container"><div class="lm-table-warning">Results of HMDB queries - Search params : Molecular specie = positive / delta (mass-to-charge ratio) = 0.05</div><div id="detail_table_source" style="display:none"></div><p><div id="choose"></div><p><div id="ms_search_0" class="ms-search-table"></div><!-- HeadRows--><table id="detail_table" class="detail"><col style="width:30px;"><!-- Ids (m/z)--><col style="width:30px;"><!-- Mass (m/z)--><col style="width:30px;"><!-- Compound--><col style="width:120px;"><!-- name--><col style="width:40px;"><!-- adduct--><col style="width:50px;"><!-- adduct type--><col style="width:60px;"><!-- adduct mw--><col style="width:60px;"><!-- cpd mw--><col style="width:50px;"><!-- delta--><thead><th>ID from input</th><th>Mass (m/z)</th><th>Compound_ID</th><th>Formula</th><th>Compound MW (Da)</th><th>Adduct</th><th>Adduct_Type</th><th>Adduct MW (Da)</th><th>Delta</th></thead><tbody class="select" id="page-id-1"><tr class="white"><td class="ca" >mz_00001</td><td id="1" class="ca" >175.01</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60293" target="_blank" class="btn">HMDB60293</a></td><td class="ca">H2O3S2</td><td class="ca">113.94453531</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">175.009875</td><td class="ca">0.000125</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03745" target="_blank" class="btn">HMDB03745</a></td><td class="ca">C2H6O3S2</td><td class="ca">141.975835438</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">175.009324</td><td class="ca">0.000676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31436" target="_blank" class="btn">HMDB31436</a></td><td class="ca">H4O4Si</td><td class="ca">95.987885149</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">175.009105</td><td class="ca">0.000895</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33657" target="_blank" class="btn">HMDB33657</a></td><td class="ca">C17H10O6</td><td class="ca">310.047738052</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.009086</td><td class="ca">0.000914</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35230" target="_blank" class="btn">HMDB35230</a></td><td class="ca">C17H10O6</td><td class="ca">310.047738052</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.009086</td><td class="ca">0.000914</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34155" target="_blank" class="btn">HMDB34155</a></td><td class="ca">CH4N2S</td><td class="ca">76.009518828</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.008256</td><td class="ca">0.001744</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01570" target="_blank" class="btn">HMDB01570</a></td><td class="ca">C10H13N2O7P</td><td class="ca">304.046037292</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.012237</td><td class="ca">0.002237</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01270" target="_blank" class="btn">HMDB01270</a></td><td class="ca">C3H8O10P2</td><td class="ca">265.9592695</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">175.013458</td><td class="ca">0.003458</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01294" target="_blank" class="btn">HMDB01294</a></td><td class="ca">C3H8O10P2</td><td class="ca">265.9592695</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">175.013458</td><td class="ca">0.003458</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60394" target="_blank" class="btn">HMDB60394</a></td><td class="ca">C9H12FN2O8P</td><td class="ca">326.031530087</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.014012</td><td class="ca">0.004012</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60015" target="_blank" class="btn">HMDB60015</a></td><td class="ca">C6H6O4S</td><td class="ca">173.99867937</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.005955</td><td class="ca">0.004045</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00021" target="_blank" class="btn">HMDB00021</a></td><td class="ca">C9H10INO3</td><td class="ca">306.970536611</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.005818</td><td class="ca">0.004182</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15167" target="_blank" class="btn">HMDB15167</a></td><td class="ca">C5H4N4S</td><td class="ca">152.015666838</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.004885</td><td class="ca">0.005115</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40364" target="_blank" class="btn">HMDB40364</a></td><td class="ca">C3H7MnO6P</td><td class="ca">224.936074104</td><td class="ca">M+3ACN+2H</td><td class="ca">+</td><td class="ca">175.015134</td><td class="ca">0.005134</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62056" target="_blank" class="btn">HMDB62056</a></td><td class="ca">C6H7O4P</td><td class="ca">174.008195703</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.015472</td><td class="ca">0.005472</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41485" target="_blank" class="btn">HMDB41485</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00209" target="_blank" class="btn">HMDB00209</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06853" target="_blank" class="btn">HMDB06853</a></td><td class="ca">C4H4O</td><td class="ca">68.02621475</td><td class="ca">2M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03767" target="_blank" class="btn">HMDB03767</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40733" target="_blank" class="btn">HMDB40733</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38176" target="_blank" class="btn">HMDB38176</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33968" target="_blank" class="btn">HMDB33968</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29635" target="_blank" class="btn">HMDB29635</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33128" target="_blank" class="btn">HMDB33128</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33766" target="_blank" class="btn">HMDB33766</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40638" target="_blank" class="btn">HMDB40638</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32568" target="_blank" class="btn">HMDB32568</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29686" target="_blank" class="btn">HMDB29686</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32603" target="_blank" class="btn">HMDB32603</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32400" target="_blank" class="btn">HMDB32400</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31459" target="_blank" class="btn">HMDB31459</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13785" target="_blank" class="btn">HMDB13785</a></td><td class="ca">C4H4O</td><td class="ca">68.02621475</td><td class="ca">2M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02340" target="_blank" class="btn">HMDB02340</a></td><td class="ca">C8H8O2</td><td class="ca">136.0524295</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.015588</td><td class="ca">0.005588</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14912" target="_blank" class="btn">HMDB14912</a></td><td class="ca">C8H8F3N3O4S2</td><td class="ca">330.990831754</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">175.015966</td><td class="ca">0.005966</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60764" target="_blank" class="btn">HMDB60764</a></td><td class="ca">C16H11ClN4O</td><td class="ca">310.062138701</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.016286</td><td class="ca">0.006286</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40238" target="_blank" class="btn">HMDB40238</a></td><td class="ca">C6H10OS</td><td class="ca">130.045235632</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.016396</td><td class="ca">0.006396</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31370" target="_blank" class="btn">HMDB31370</a></td><td class="ca">C6H10OS</td><td class="ca">130.045235632</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.016396</td><td class="ca">0.006396</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37493" target="_blank" class="btn">HMDB37493</a></td><td class="ca">C6H10OS</td><td class="ca">130.045235632</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.016396</td><td class="ca">0.006396</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37787" target="_blank" class="btn">HMDB37787</a></td><td class="ca">C5H10N2</td><td class="ca">98.08439833</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.003438</td><td class="ca">0.006562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61807" target="_blank" class="btn">HMDB61807</a></td><td class="ca">C10H9Cl3O2</td><td class="ca">265.966812653</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">175.017229</td><td class="ca">0.007229</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59985" target="_blank" class="btn">HMDB59985</a></td><td class="ca">C11H12O8S</td><td class="ca">304.02528805</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.001862</td><td class="ca">0.008138</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59987" target="_blank" class="btn">HMDB59987</a></td><td class="ca">C11H12O8S</td><td class="ca">304.02528805</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.001862</td><td class="ca">0.008138</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60020" target="_blank" class="btn">HMDB60020</a></td><td class="ca">C11H12O8S</td><td class="ca">304.02528805</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.001862</td><td class="ca">0.008138</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14581" target="_blank" class="btn">HMDB14581</a></td><td class="ca">C5H4N4O</td><td class="ca">136.03851077</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.001669</td><td class="ca">0.008331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00157" target="_blank" class="btn">HMDB00157</a></td><td class="ca">C5H4N4O</td><td class="ca">136.03851077</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.001669</td><td class="ca">0.008331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40631" target="_blank" class="btn">HMDB40631</a></td><td class="ca">C15H12O7</td><td class="ca">304.058302738</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.018369</td><td class="ca">0.008369</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31778" target="_blank" class="btn">HMDB31778</a></td><td class="ca">C14H9ClF2N2O2</td><td class="ca">310.032061659</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.001248</td><td class="ca">0.008752</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31160" target="_blank" class="btn">HMDB31160</a></td><td class="ca">C5H12S2</td><td class="ca">136.038041764</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.0012</td><td class="ca">0.0088</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33053" target="_blank" class="btn">HMDB33053</a></td><td class="ca">C5H12S2</td><td class="ca">136.038041764</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.0012</td><td class="ca">0.0088</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33054" target="_blank" class="btn">HMDB33054</a></td><td class="ca">C5H12S2</td><td class="ca">136.038041764</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.0012</td><td class="ca">0.0088</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29694" target="_blank" class="btn">HMDB29694</a></td><td class="ca">C8H8OS</td><td class="ca">152.029585568</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.018804</td><td class="ca">0.008804</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29783" target="_blank" class="btn">HMDB29783</a></td><td class="ca">C14H14O8</td><td class="ca">310.068867424</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.019651</td><td class="ca">0.009651</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00613" target="_blank" class="btn">HMDB00613</a></td><td class="ca">C4H8O5</td><td class="ca">136.037173366</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.000331</td><td class="ca">0.009669</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00943" target="_blank" class="btn">HMDB00943</a></td><td class="ca">C4H8O5</td><td class="ca">136.037173366</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.000331</td><td class="ca">0.009669</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00115" target="_blank" class="btn">HMDB00115</a></td><td class="ca">C2H4O3</td><td class="ca">76.016043994</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.021306</td><td class="ca">0.011306</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31608" target="_blank" class="btn">HMDB31608</a></td><td class="ca">C2H4O3</td><td class="ca">76.016043994</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.021306</td><td class="ca">0.011306</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41797" target="_blank" class="btn">HMDB41797</a></td><td class="ca">C8H6Cl2O3</td><td class="ca">219.969399472</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">174.998239</td><td class="ca">0.011761</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15413" target="_blank" class="btn">HMDB15413</a></td><td class="ca">C12H14N4O4S</td><td class="ca">310.073575646</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.022005</td><td class="ca">0.012005</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15621" target="_blank" class="btn">HMDB15621</a></td><td class="ca">C12H14N4O4S</td><td class="ca">310.073575646</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.022005</td><td class="ca">0.012005</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31825" target="_blank" class="btn">HMDB31825</a></td><td class="ca">C8H8S</td><td class="ca">136.034670946</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">174.997829</td><td class="ca">0.012171</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31781" target="_blank" class="btn">HMDB31781</a></td><td class="ca">C14H15O2PS2</td><td class="ca">310.025107616</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">174.997771</td><td class="ca">0.012229</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00634" target="_blank" class="btn">HMDB00634</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00620" target="_blank" class="btn">HMDB00620</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61185" target="_blank" class="btn">HMDB61185</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00749" target="_blank" class="btn">HMDB00749</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02092" target="_blank" class="btn">HMDB02092</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33809" target="_blank" class="btn">HMDB33809</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13233" target="_blank" class="btn">HMDB13233</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59743" target="_blank" class="btn">HMDB59743</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60365" target="_blank" class="btn">HMDB60365</a></td><td class="ca">C5H6O4</td><td class="ca">130.02660868</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.997769</td><td class="ca">0.012231</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60689" target="_blank" class="btn">HMDB60689</a></td><td class="ca">C4H11Cl2N2O2P</td><td class="ca">219.993519532</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">175.02236</td><td class="ca">0.01236</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60691" target="_blank" class="btn">HMDB60691</a></td><td class="ca">C4H11Cl2N2O2P</td><td class="ca">219.993519532</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">175.02236</td><td class="ca">0.01236</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00292" target="_blank" class="btn">HMDB00292</a></td><td class="ca">C5H4N4O2</td><td class="ca">152.033425392</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.022643</td><td class="ca">0.012643</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00786" target="_blank" class="btn">HMDB00786</a></td><td class="ca">C5H4N4O2</td><td class="ca">152.033425392</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.022643</td><td class="ca">0.012643</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01182" target="_blank" class="btn">HMDB01182</a></td><td class="ca">C5H4N4O2</td><td class="ca">152.033425392</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.022643</td><td class="ca">0.012643</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00072" target="_blank" class="btn">HMDB00072</a></td><td class="ca">C6H6O6</td><td class="ca">174.016437924</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.023714</td><td class="ca">0.013714</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00958" target="_blank" class="btn">HMDB00958</a></td><td class="ca">C6H6O6</td><td class="ca">174.016437924</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.023714</td><td class="ca">0.013714</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01264" target="_blank" class="btn">HMDB01264</a></td><td class="ca">C6H6O6</td><td class="ca">174.016437924</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.023714</td><td class="ca">0.013714</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61101" target="_blank" class="btn">HMDB61101</a></td><td class="ca">C11H10BrN5O</td><td class="ca">307.006872614</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.023986</td><td class="ca">0.013986</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01520" target="_blank" class="btn">HMDB01520</a></td><td class="ca">C17H21N4O9P</td><td class="ca">456.104614802</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.02409</td><td class="ca">0.01409</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37945" target="_blank" class="btn">HMDB37945</a></td><td class="ca">C23H20O10</td><td class="ca">456.10564686</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.024434</td><td class="ca">0.014434</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39328" target="_blank" class="btn">HMDB39328</a></td><td class="ca">C23H20O10</td><td class="ca">456.10564686</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.024434</td><td class="ca">0.014434</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40200" target="_blank" class="btn">HMDB40200</a></td><td class="ca">C7H10OS2</td><td class="ca">174.017306322</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.024582</td><td class="ca">0.014582</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29614" target="_blank" class="btn">HMDB29614</a></td><td class="ca">C13H21O2PS2</td><td class="ca">304.072057808</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.025247</td><td class="ca">0.015247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32909" target="_blank" class="btn">HMDB32909</a></td><td class="ca">C19H12O4</td><td class="ca">304.073558872</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.025997</td><td class="ca">0.015997</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38322" target="_blank" class="btn">HMDB38322</a></td><td class="ca">C19H12O4</td><td class="ca">304.073558872</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.025997</td><td class="ca">0.015997</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41450" target="_blank" class="btn">HMDB41450</a></td><td class="ca">C19H12O4</td><td class="ca">304.073558872</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.025997</td><td class="ca">0.015997</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15176" target="_blank" class="btn">HMDB15176</a></td><td class="ca">C13H18Cl2N2O2</td><td class="ca">304.074533244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.026485</td><td class="ca">0.016485</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03152" target="_blank" class="btn">HMDB03152</a></td><td class="ca">C7H8N2O</td><td class="ca">136.063662888</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.026821</td><td class="ca">0.016821</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33947" target="_blank" class="btn">HMDB33947</a></td><td class="ca">C7H8N2O</td><td class="ca">136.063662888</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.026821</td><td class="ca">0.016821</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37819" target="_blank" class="btn">HMDB37819</a></td><td class="ca">C7H8N2O</td><td class="ca">136.063662888</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.026821</td><td class="ca">0.016821</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30001" target="_blank" class="btn">HMDB30001</a></td><td class="ca">C7H8N2O</td><td class="ca">136.063662888</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.026821</td><td class="ca">0.016821</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59711" target="_blank" class="btn">HMDB59711</a></td><td class="ca">C7H8N2O</td><td class="ca">136.063662888</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.026821</td><td class="ca">0.016821</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40357" target="_blank" class="btn">HMDB40357</a></td><td class="ca">C18H14O5</td><td class="ca">310.084123558</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.027279</td><td class="ca">0.017279</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03315" target="_blank" class="btn">HMDB03315</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31563" target="_blank" class="btn">HMDB31563</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30332" target="_blank" class="btn">HMDB30332</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31564" target="_blank" class="btn">HMDB31564</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33714" target="_blank" class="btn">HMDB33714</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33549" target="_blank" class="btn">HMDB33549</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31498" target="_blank" class="btn">HMDB31498</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31497" target="_blank" class="btn">HMDB31497</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31196" target="_blank" class="btn">HMDB31196</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31496" target="_blank" class="btn">HMDB31496</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35239" target="_blank" class="btn">HMDB35239</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40264" target="_blank" class="btn">HMDB40264</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40271" target="_blank" class="btn">HMDB40271</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62031" target="_blank" class="btn">HMDB62031</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62127" target="_blank" class="btn">HMDB62127</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.992205</td><td class="ca">0.017795</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62136" target="_blank" class="btn">HMDB62136</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61783" target="_blank" class="btn">HMDB61783</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61892" target="_blank" class="btn">HMDB61892</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61893" target="_blank" class="btn">HMDB61893</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61895" target="_blank" class="btn">HMDB61895</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61894" target="_blank" class="btn">HMDB61894</a></td><td class="ca">C7H14</td><td class="ca">98.109550448</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">175.02859</td><td class="ca">0.01859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15679" target="_blank" class="btn">HMDB15679</a></td><td class="ca">C13H8Cl2N2O4</td><td class="ca">325.986112168</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">174.991303</td><td class="ca">0.018697</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61135" target="_blank" class="btn">HMDB61135</a></td><td class="ca">C16H17ClN2S</td><td class="ca">304.080096951</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.029266</td><td class="ca">0.019266</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29199" target="_blank" class="btn">HMDB29199</a></td><td class="ca">C14H14O9</td><td class="ca">326.063782046</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.030138</td><td class="ca">0.020138</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12152" target="_blank" class="btn">HMDB12152</a></td><td class="ca">C9H17O12P</td><td class="ca">348.04576252</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">175.030157</td><td class="ca">0.020157</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00175" target="_blank" class="btn">HMDB00175</a></td><td class="ca">C10H13N4O8P</td><td class="ca">348.047099924</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">175.030826</td><td class="ca">0.020826</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11681" target="_blank" class="btn">HMDB11681</a></td><td class="ca">C10H13N4O8P</td><td class="ca">348.047099924</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">175.030826</td><td class="ca">0.020826</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14684" target="_blank" class="btn">HMDB14684</a></td><td class="ca">C4H3FN2O2</td><td class="ca">130.017855555</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.989016</td><td class="ca">0.020984</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39638" target="_blank" class="btn">HMDB39638</a></td><td class="ca">C9H6N2S</td><td class="ca">174.025168892</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.032445</td><td class="ca">0.022445</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60086" target="_blank" class="btn">HMDB60086</a></td><td class="ca">C18H24N4O8S</td><td class="ca">456.131484454</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.033046</td><td class="ca">0.023046</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14649" target="_blank" class="btn">HMDB14649</a></td><td class="ca">C12H9N3O5S</td><td class="ca">307.026291103</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.033696</td><td class="ca">0.023696</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00695" target="_blank" class="btn">HMDB00695</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00408" target="_blank" class="btn">HMDB00408</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00491" target="_blank" class="btn">HMDB00491</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01864" target="_blank" class="btn">HMDB01864</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06024" target="_blank" class="btn">HMDB06024</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB10717" target="_blank" class="btn">HMDB10717</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33302" target="_blank" class="btn">HMDB33302</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33286" target="_blank" class="btn">HMDB33286</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31216" target="_blank" class="btn">HMDB31216</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31218" target="_blank" class="btn">HMDB31218</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33698" target="_blank" class="btn">HMDB33698</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31214" target="_blank" class="btn">HMDB31214</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59876" target="_blank" class="btn">HMDB59876</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12882" target="_blank" class="btn">HMDB12882</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61881" target="_blank" class="btn">HMDB61881</a></td><td class="ca">C6H10O3</td><td class="ca">130.062994186</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.034154</td><td class="ca">0.024154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59664" target="_blank" class="btn">HMDB59664</a></td><td class="ca">C4H8O2S2</td><td class="ca">151.99657088</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.985789</td><td class="ca">0.024211</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31188" target="_blank" class="btn">HMDB31188</a></td><td class="ca">C2H4OS</td><td class="ca">75.99828544</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">174.985789</td><td class="ca">0.024211</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35716" target="_blank" class="btn">HMDB35716</a></td><td class="ca">C4H8O2S2</td><td class="ca">151.99657088</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.985789</td><td class="ca">0.024211</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33670" target="_blank" class="btn">HMDB33670</a></td><td class="ca">C4H8O2S2</td><td class="ca">151.99657088</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.985789</td><td class="ca">0.024211</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01067" target="_blank" class="btn">HMDB01067</a></td><td class="ca">C11H16N2O8</td><td class="ca">304.090665498</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.034551</td><td class="ca">0.024551</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02818" target="_blank" class="btn">HMDB02818</a></td><td class="ca">C4H2N2O4</td><td class="ca">142.001456562</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">175.034946</td><td class="ca">0.024946</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38442" target="_blank" class="btn">HMDB38442</a></td><td class="ca">C4H7NS2</td><td class="ca">133.001990609</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">175.035814</td><td class="ca">0.025814</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00703" target="_blank" class="btn">HMDB00703</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01101" target="_blank" class="btn">HMDB01101</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00020" target="_blank" class="btn">HMDB00020</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00440" target="_blank" class="btn">HMDB00440</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00669" target="_blank" class="btn">HMDB00669</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02390" target="_blank" class="btn">HMDB02390</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03791" target="_blank" class="btn">HMDB03791</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04815" target="_blank" class="btn">HMDB04815</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12308" target="_blank" class="btn">HMDB12308</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30662" target="_blank" class="btn">HMDB30662</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41507" target="_blank" class="btn">HMDB41507</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36907" target="_blank" class="btn">HMDB36907</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32919" target="_blank" class="btn">HMDB32919</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41283" target="_blank" class="btn">HMDB41283</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29657" target="_blank" class="btn">HMDB29657</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32606" target="_blank" class="btn">HMDB32606</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34172" target="_blank" class="btn">HMDB34172</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30745" target="_blank" class="btn">HMDB30745</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32604" target="_blank" class="btn">HMDB32604</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29661" target="_blank" class="btn">HMDB29661</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29662" target="_blank" class="btn">HMDB29662</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32572" target="_blank" class="btn">HMDB32572</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32629" target="_blank" class="btn">HMDB32629</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33003" target="_blank" class="btn">HMDB33003</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41294" target="_blank" class="btn">HMDB41294</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32594" target="_blank" class="btn">HMDB32594</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31609" target="_blank" class="btn">HMDB31609</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29658" target="_blank" class="btn">HMDB29658</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29659" target="_blank" class="btn">HMDB29659</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33866" target="_blank" class="btn">HMDB33866</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29660" target="_blank" class="btn">HMDB29660</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32399" target="_blank" class="btn">HMDB32399</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38519" target="_blank" class="btn">HMDB38519</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29179" target="_blank" class="btn">HMDB29179</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29175" target="_blank" class="btn">HMDB29175</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29228" target="_blank" class="btn">HMDB29228</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29231" target="_blank" class="btn">HMDB29231</a></td><td class="ca">C16H16O6</td><td class="ca">304.094688244</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60390" target="_blank" class="btn">HMDB60390</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344122</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62005" target="_blank" class="btn">HMDB62005</a></td><td class="ca">C8H8O3</td><td class="ca">152.047344118</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.036562</td><td class="ca">0.026562</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11659" target="_blank" class="btn">HMDB11659</a></td><td class="ca">C5H12O4</td><td class="ca">136.073558872</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.036717</td><td class="ca">0.026717</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33919" target="_blank" class="btn">HMDB33919</a></td><td class="ca">C5H12O4</td><td class="ca">136.073558872</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.036717</td><td class="ca">0.026717</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31201" target="_blank" class="btn">HMDB31201</a></td><td class="ca">C5H12O4</td><td class="ca">136.073558872</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.036717</td><td class="ca">0.026717</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14805" target="_blank" class="btn">HMDB14805</a></td><td class="ca">C5H15N3O8P2</td><td class="ca">307.033437495</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.037269</td><td class="ca">0.027269</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00973" target="_blank" class="btn">HMDB00973</a></td><td class="ca">HO4P</td><td class="ca">95.961245032</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">174.982465</td><td class="ca">0.027535</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36343" target="_blank" class="btn">HMDB36343</a></td><td class="ca">C18H14O6</td><td class="ca">326.07903818</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.037766</td><td class="ca">0.027766</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33100" target="_blank" class="btn">HMDB33100</a></td><td class="ca">C18H14O6</td><td class="ca">326.07903818</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.037766</td><td class="ca">0.027766</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37570" target="_blank" class="btn">HMDB37570</a></td><td class="ca">C18H14O6</td><td class="ca">326.07903818</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.037766</td><td class="ca">0.027766</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30590" target="_blank" class="btn">HMDB30590</a></td><td class="ca">C18H14O6</td><td class="ca">326.07903818</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.037766</td><td class="ca">0.027766</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35880" target="_blank" class="btn">HMDB35880</a></td><td class="ca">C15H18O7</td><td class="ca">310.10525293</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.037843</td><td class="ca">0.027843</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30293" target="_blank" class="btn">HMDB30293</a></td><td class="ca">C15H18O7</td><td class="ca">310.10525293</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.037843</td><td class="ca">0.027843</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39958" target="_blank" class="btn">HMDB39958</a></td><td class="ca">C15H18O7</td><td class="ca">310.10525293</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.037843</td><td class="ca">0.027843</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01216" target="_blank" class="btn">HMDB01216</a></td><td class="ca">C6H8N4</td><td class="ca">136.074896276</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.038054</td><td class="ca">0.028054</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01525" target="_blank" class="btn">HMDB01525</a></td><td class="ca">C3H4N2</td><td class="ca">68.037448138</td><td class="ca">2M+K</td><td class="ca">+</td><td class="ca">175.038054</td><td class="ca">0.028054</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30577" target="_blank" class="btn">HMDB30577</a></td><td class="ca">C10H6O3</td><td class="ca">174.031694058</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.03897</td><td class="ca">0.02897</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30773" target="_blank" class="btn">HMDB30773</a></td><td class="ca">C10H6O3</td><td class="ca">174.031694058</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">175.03897</td><td class="ca">0.02897</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59586" target="_blank" class="btn">HMDB59586</a></td><td class="ca">C8HF17O3S</td><td class="ca">499.937494073</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">174.980421</td><td class="ca">0.029579</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32943" target="_blank" class="btn">HMDB32943</a></td><td class="ca">C12H21N2O3PS</td><td class="ca">304.10104975</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.039743</td><td class="ca">0.029743</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33548" target="_blank" class="btn">HMDB33548</a></td><td class="ca">C5H6O2S</td><td class="ca">130.008850126</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.98001</td><td class="ca">0.02999</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34073" target="_blank" class="btn">HMDB34073</a></td><td class="ca">C10H16N4O7</td><td class="ca">304.101898886</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.040167</td><td class="ca">0.030167</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39723" target="_blank" class="btn">HMDB39723</a></td><td class="ca">C11H18O11</td><td class="ca">326.084911418</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.040703</td><td class="ca">0.030703</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40737" target="_blank" class="btn">HMDB40737</a></td><td class="ca">C11H18O11</td><td class="ca">326.084911418</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.040703</td><td class="ca">0.030703</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60455" target="_blank" class="btn">HMDB60455</a></td><td class="ca">C6H3ClO4</td><td class="ca">173.971986291</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">174.979262</td><td class="ca">0.030738</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38263" target="_blank" class="btn">HMDB38263</a></td><td class="ca">C23H22O14</td><td class="ca">522.100955412</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.040928</td><td class="ca">0.030928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37457" target="_blank" class="btn">HMDB37457</a></td><td class="ca">C23H22O14</td><td class="ca">522.100955412</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.040928</td><td class="ca">0.030928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35462" target="_blank" class="btn">HMDB35462</a></td><td class="ca">C23H22O14</td><td class="ca">522.100955412</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.040928</td><td class="ca">0.030928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38262" target="_blank" class="btn">HMDB38262</a></td><td class="ca">C23H22O14</td><td class="ca">522.100955412</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.040928</td><td class="ca">0.030928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12916" target="_blank" class="btn">HMDB12916</a></td><td class="ca">CH2NO2S</td><td class="ca">91.980624003</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">175.040994</td><td class="ca">0.030994</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11688" target="_blank" class="btn">HMDB11688</a></td><td class="ca">C5H12O11P2</td><td class="ca">309.98548425</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">174.977959</td><td class="ca">0.032041</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38665" target="_blank" class="btn">HMDB38665</a></td><td class="ca">C15H16N2O5</td><td class="ca">304.105921632</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.042179</td><td class="ca">0.032179</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61312" target="_blank" class="btn">HMDB61312</a></td><td class="ca">C15H14ClNO2S</td><td class="ca">307.043377094</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.042239</td><td class="ca">0.032239</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37731" target="_blank" class="btn">HMDB37731</a></td><td class="ca">C6H6O2S</td><td class="ca">142.008850126</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">175.042339</td><td class="ca">0.032339</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37762" target="_blank" class="btn">HMDB37762</a></td><td class="ca">C6H6O2S</td><td class="ca">142.008850126</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">175.042339</td><td class="ca">0.032339</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29719" target="_blank" class="btn">HMDB29719</a></td><td class="ca">C6H6O2S</td><td class="ca">142.008850126</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">175.042339</td><td class="ca">0.032339</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60503" target="_blank" class="btn">HMDB60503</a></td><td class="ca">C5H4O2</td><td class="ca">96.021129372</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">175.042349</td><td class="ca">0.032349</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32914" target="_blank" class="btn">HMDB32914</a></td><td class="ca">C5H4O2</td><td class="ca">96.021129372</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">175.042349</td><td class="ca">0.032349</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62029" target="_blank" class="btn">HMDB62029</a></td><td class="ca">C5H4O2</td><td class="ca">96.021129369</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">175.042349</td><td class="ca">0.032349</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01059" target="_blank" class="btn">HMDB01059</a></td><td class="ca">C6H16O18P4</td><td class="ca">499.928709756</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">174.977493</td><td class="ca">0.032507</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01187" target="_blank" class="btn">HMDB01187</a></td><td class="ca">C6H16O18P4</td><td class="ca">499.928709756</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">174.977493</td><td class="ca">0.032507</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03848" target="_blank" class="btn">HMDB03848</a></td><td class="ca">C6H16O18P4</td><td class="ca">499.928709756</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">174.977493</td><td class="ca">0.032507</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04527" target="_blank" class="btn">HMDB04527</a></td><td class="ca">C6H16O18P4</td><td class="ca">499.928709756</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">174.977493</td><td class="ca">0.032507</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11741" target="_blank" class="btn">HMDB11741</a></td><td class="ca">C14H18N2O6</td><td class="ca">310.116486318</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.04346</td><td class="ca">0.03346</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15140" target="_blank" class="btn">HMDB15140</a></td><td class="ca">CH4N2O2</td><td class="ca">76.027277382</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.043773</td><td class="ca">0.033773</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34833" target="_blank" class="btn">HMDB34833</a></td><td class="ca">H8N2S</td><td class="ca">68.040818956</td><td class="ca">2M+K</td><td class="ca">+</td><td class="ca">175.044796</td><td class="ca">0.034796</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33956" target="_blank" class="btn">HMDB33956</a></td><td class="ca">C4H7Cl2O4P</td><td class="ca">219.945900638</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">174.974741</td><td class="ca">0.035259</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29396" target="_blank" class="btn">HMDB29396</a></td><td class="ca">C5H10N2O2</td><td class="ca">130.074227574</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.045388</td><td class="ca">0.035388</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30405" target="_blank" class="btn">HMDB30405</a></td><td class="ca">C5H10N2O2</td><td class="ca">130.074227574</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.045388</td><td class="ca">0.035388</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36635" target="_blank" class="btn">HMDB36635</a></td><td class="ca">C19H18O4</td><td class="ca">310.120509064</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.045472</td><td class="ca">0.035472</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41298" target="_blank" class="btn">HMDB41298</a></td><td class="ca">C19H18O4</td><td class="ca">310.120509064</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.045472</td><td class="ca">0.035472</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33310" target="_blank" class="btn">HMDB33310</a></td><td class="ca">C19H18O4</td><td class="ca">310.120509064</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.045472</td><td class="ca">0.035472</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31744" target="_blank" class="btn">HMDB31744</a></td><td class="ca">C19H18O4</td><td class="ca">310.120509064</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.045472</td><td class="ca">0.035472</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00839" target="_blank" class="btn">HMDB00839</a></td><td class="ca">C20H14N4</td><td class="ca">310.121846468</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.04614</td><td class="ca">0.03614</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39926" target="_blank" class="btn">HMDB39926</a></td><td class="ca">C22H28O11S</td><td class="ca">500.135232428</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">175.046334</td><td class="ca">0.036334</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01448" target="_blank" class="btn">HMDB01448</a></td><td class="ca">O4S</td><td class="ca">95.951729178</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">174.972949</td><td class="ca">0.037051</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15102" target="_blank" class="btn">HMDB15102</a></td><td class="ca">C19H19ClN2</td><td class="ca">310.123676325</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.047055</td><td class="ca">0.037055</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04230" target="_blank" class="btn">HMDB04230</a></td><td class="ca">C5H5NO2</td><td class="ca">111.032028409</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">175.047793</td><td class="ca">0.037793</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38175" target="_blank" class="btn">HMDB38175</a></td><td class="ca">C5H5NO2</td><td class="ca">111.032028409</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">175.047793</td><td class="ca">0.037793</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04194" target="_blank" class="btn">HMDB04194</a></td><td class="ca">C7H8N2O2</td><td class="ca">152.05857751</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.047796</td><td class="ca">0.037796</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04193" target="_blank" class="btn">HMDB04193</a></td><td class="ca">C7H8N2O2</td><td class="ca">152.05857751</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.047796</td><td class="ca">0.037796</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33581" target="_blank" class="btn">HMDB33581</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39509" target="_blank" class="btn">HMDB39509</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39167" target="_blank" class="btn">HMDB39167</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39169" target="_blank" class="btn">HMDB39169</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36936" target="_blank" class="btn">HMDB36936</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36735" target="_blank" class="btn">HMDB36735</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60077" target="_blank" class="btn">HMDB60077</a></td><td class="ca">C15H18O8</td><td class="ca">326.100167552</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.048331</td><td class="ca">0.038331</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36981" target="_blank" class="btn">HMDB36981</a></td><td class="ca">C25H28O8</td><td class="ca">456.178417872</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.048691</td><td class="ca">0.038691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01202" target="_blank" class="btn">HMDB01202</a></td><td class="ca">C9H14N3O7P</td><td class="ca">307.056936329</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">175.049018</td><td class="ca">0.039018</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60488" target="_blank" class="btn">HMDB60488</a></td><td class="ca">CH4Se</td><td class="ca">95.947821956</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">174.969042</td><td class="ca">0.040958</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30879" target="_blank" class="btn">HMDB30879</a></td><td class="ca">C2H6SSe</td><td class="ca">141.93554271</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">174.969032</td><td class="ca">0.040968</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03638" target="_blank" class="btn">HMDB03638</a></td><td class="ca">Cd</td><td class="ca">113.903358121</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">174.968698</td><td class="ca">0.041302</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14694" target="_blank" class="btn">HMDB14694</a></td><td class="ca">C15H13N3O4S</td><td class="ca">331.062676609</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">175.051888</td><td class="ca">0.041888</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34416" target="_blank" class="btn">HMDB34416</a></td><td class="ca">C4H8S3</td><td class="ca">151.978812326</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.96803</td><td class="ca">0.04197</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37290" target="_blank" class="btn">HMDB37290</a></td><td class="ca">C4H8S3</td><td class="ca">151.978812326</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.96803</td><td class="ca">0.04197</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31470" target="_blank" class="btn">HMDB31470</a></td><td class="ca">C4H8S3</td><td class="ca">151.978812326</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.96803</td><td class="ca">0.04197</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31628" target="_blank" class="btn">HMDB31628</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34378" target="_blank" class="btn">HMDB34378</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31627" target="_blank" class="btn">HMDB31627</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33962" target="_blank" class="btn">HMDB33962</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31312" target="_blank" class="btn">HMDB31312</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38985" target="_blank" class="btn">HMDB38985</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32621" target="_blank" class="btn">HMDB32621</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38988" target="_blank" class="btn">HMDB38988</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32624" target="_blank" class="btn">HMDB32624</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38986" target="_blank" class="btn">HMDB38986</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39782" target="_blank" class="btn">HMDB39782</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29667" target="_blank" class="btn">HMDB29667</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32625" target="_blank" class="btn">HMDB32625</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32149" target="_blank" class="btn">HMDB32149</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32029" target="_blank" class="btn">HMDB32029</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38987" target="_blank" class="btn">HMDB38987</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38984" target="_blank" class="btn">HMDB38984</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32544" target="_blank" class="btn">HMDB32544</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31446" target="_blank" class="btn">HMDB31446</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32441" target="_blank" class="btn">HMDB32441</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59896" target="_blank" class="btn">HMDB59896</a></td><td class="ca">C9H12O</td><td class="ca">136.088815006</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">175.051973</td><td class="ca">0.041973</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34894" target="_blank" class="btn">HMDB34894</a></td><td class="ca">C12H20N2O7</td><td class="ca">304.127051004</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.052744</td><td class="ca">0.042744</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38696" target="_blank" class="btn">HMDB38696</a></td><td class="ca">C12H20N2O7</td><td class="ca">304.127051004</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.052744</td><td class="ca">0.042744</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33909" target="_blank" class="btn">HMDB33909</a></td><td class="ca">C12H20N2O7</td><td class="ca">304.127051004</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.052744</td><td class="ca">0.042744</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31537" target="_blank" class="btn">HMDB31537</a></td><td class="ca">C7H14S</td><td class="ca">130.081621138</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">175.052781</td><td class="ca">0.042781</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02332" target="_blank" class="btn">HMDB02332</a></td><td class="ca">C3H4O5S</td><td class="ca">151.977943928</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">174.967162</td><td class="ca">0.042838</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60768" target="_blank" class="btn">HMDB60768</a></td><td class="ca">C4H6N2O</td><td class="ca">98.048012824</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">174.967053</td><td class="ca">0.042947</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37336" target="_blank" class="btn">HMDB37336</a></td><td class="ca">C24H26O13</td><td class="ca">522.137340918</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.053056</td><td class="ca">0.043056</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33705" target="_blank" class="btn">HMDB33705</a></td><td class="ca">C24H26O13</td><td class="ca">522.137340918</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">175.053056</td><td class="ca">0.043056</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62164" target="_blank" class="btn">HMDB62164</a></td><td class="ca">C4H7NO2S</td><td class="ca">133.019749643</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">175.053573</td><td class="ca">0.043573</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12236" target="_blank" class="btn">HMDB12236</a></td><td class="ca">C6H9N2O5P</td><td class="ca">220.02490792</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">175.053748</td><td class="ca">0.043748</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39123" target="_blank" class="btn">HMDB39123</a></td><td class="ca">C14H18N2O7</td><td class="ca">326.11140094</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.053947</td><td class="ca">0.043947</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14843" target="_blank" class="btn">HMDB14843</a></td><td class="ca">C22H28N6O3S</td><td class="ca">456.194359482</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">175.054004</td><td class="ca">0.044004</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39777" target="_blank" class="btn">HMDB39777</a></td><td class="ca">C28H24N2O7</td><td class="ca">500.158351132</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">175.05404</td><td class="ca">0.04404</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00905" target="_blank" class="btn">HMDB00905</a></td><td class="ca">C10H14N5O6P</td><td class="ca">331.068169717</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">175.054635</td><td class="ca">0.044635</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37494" target="_blank" class="btn">HMDB37494</a></td><td class="ca">C17H20O5</td><td class="ca">304.13107375</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.054755</td><td class="ca">0.044755</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35790" target="_blank" class="btn">HMDB35790</a></td><td class="ca">C17H20O5</td><td class="ca">304.13107375</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.054755</td><td class="ca">0.044755</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29305" target="_blank" class="btn">HMDB29305</a></td><td class="ca">C17H20O5</td><td class="ca">304.13107375</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">175.054755</td><td class="ca">0.044755</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32956" target="_blank" class="btn">HMDB32956</a></td><td class="ca">C12H10O7</td><td class="ca">266.042652674</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">175.055149</td><td class="ca">0.045149</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32746" target="_blank" class="btn">HMDB32746</a></td><td class="ca">C4H8OS2</td><td class="ca">136.001656258</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">174.964814</td><td class="ca">0.045186</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32747" target="_blank" class="btn">HMDB32747</a></td><td class="ca">C4H8OS2</td><td class="ca">136.001656258</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">174.964814</td><td class="ca">0.045186</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32744" target="_blank" class="btn">HMDB32744</a></td><td class="ca">C4H8OS2</td><td class="ca">136.001656258</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">174.964814</td><td class="ca">0.045186</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32745" target="_blank" class="btn">HMDB32745</a></td><td class="ca">C4H8OS2</td><td class="ca">136.001656258</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">174.964814</td><td class="ca">0.045186</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34015" target="_blank" class="btn">HMDB34015</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30606" target="_blank" class="btn">HMDB30606</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30605" target="_blank" class="btn">HMDB30605</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40315" target="_blank" class="btn">HMDB40315</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40313" target="_blank" class="btn">HMDB40313</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41299" target="_blank" class="btn">HMDB41299</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40930" target="_blank" class="btn">HMDB40930</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34279" target="_blank" class="btn">HMDB34279</a></td><td class="ca">C19H18O5</td><td class="ca">326.115423686</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.055959</td><td class="ca">0.045959</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00508" target="_blank" class="btn">HMDB00508</a></td><td class="ca">C5H12O5</td><td class="ca">152.068473494</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.057691</td><td class="ca">0.047691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00568" target="_blank" class="btn">HMDB00568</a></td><td class="ca">C5H12O5</td><td class="ca">152.068473494</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.057691</td><td class="ca">0.047691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01851" target="_blank" class="btn">HMDB01851</a></td><td class="ca">C5H12O5</td><td class="ca">152.068473494</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.057691</td><td class="ca">0.047691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02917" target="_blank" class="btn">HMDB02917</a></td><td class="ca">C5H12O5</td><td class="ca">152.068473494</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.057691</td><td class="ca">0.047691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33730" target="_blank" class="btn">HMDB33730</a></td><td class="ca">C5H12O5</td><td class="ca">152.068473494</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">175.057691</td><td class="ca">0.047691</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39788" target="_blank" class="btn">HMDB39788</a></td><td class="ca">C5H6S2</td><td class="ca">129.991091572</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.962252</td><td class="ca">0.047748</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39787" target="_blank" class="btn">HMDB39787</a></td><td class="ca">C5H6S2</td><td class="ca">129.991091572</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.962252</td><td class="ca">0.047748</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31853" target="_blank" class="btn">HMDB31853</a></td><td class="ca">C5H6S2</td><td class="ca">129.991091572</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.962252</td><td class="ca">0.047748</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32939" target="_blank" class="btn">HMDB32939</a></td><td class="ca">C5H6S2</td><td class="ca">129.991091572</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">174.962252</td><td class="ca">0.047748</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14118" target="_blank" class="btn">HMDB14118</a></td><td class="ca">C2HF3O2</td><td class="ca">113.992863891</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">175.058204</td><td class="ca">0.048204</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31238" target="_blank" class="btn">HMDB31238</a></td><td class="ca">C3H8S</td><td class="ca">76.034670946</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.05856</td><td class="ca">0.04856</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31634" target="_blank" class="btn">HMDB31634</a></td><td class="ca">C3H8S</td><td class="ca">76.034670946</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.05856</td><td class="ca">0.04856</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34238" target="_blank" class="btn">HMDB34238</a></td><td class="ca">C3H8S</td><td class="ca">76.034670946</td><td class="ca">2M+Na</td><td class="ca">+</td><td class="ca">175.05856</td><td class="ca">0.04856</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15583" target="_blank" class="btn">HMDB15583</a></td><td class="ca">C22H18N2</td><td class="ca">310.146998586</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.058716</td><td class="ca">0.048716</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06590" target="_blank" class="btn">HMDB06590</a></td><td class="ca">C12H22O10</td><td class="ca">326.121296924</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.058895</td><td class="ca">0.048895</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06701" target="_blank" class="btn">HMDB06701</a></td><td class="ca">C12H22O10</td><td class="ca">326.121296924</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.058895</td><td class="ca">0.048895</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29523" target="_blank" class="btn">HMDB29523</a></td><td class="ca">C12H22O10</td><td class="ca">326.121296924</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.058895</td><td class="ca">0.048895</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40154" target="_blank" class="btn">HMDB40154</a></td><td class="ca">C12H22O10</td><td class="ca">326.121296924</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.058895</td><td class="ca">0.048895</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00630" target="_blank" class="btn">HMDB00630</a></td><td class="ca">C4H5N3O</td><td class="ca">111.043261797</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">175.059027</td><td class="ca">0.049027</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14021" target="_blank" class="btn">HMDB14021</a></td><td class="ca">C19H19FN2O</td><td class="ca">310.148141445</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.059288</td><td class="ca">0.049288</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60576" target="_blank" class="btn">HMDB60576</a></td><td class="ca">C19H19FN2O</td><td class="ca">310.148141445</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">175.059288</td><td class="ca">0.049288</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03826" target="_blank" class="btn">HMDB03826</a></td><td class="ca">C13H18N4O6</td><td class="ca">326.122634328</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">175.059564</td><td class="ca">0.049564</td></tr><tr class="green"><td class="ca" >mz_00002</td><td id="2" class="ca" >238.19</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04043" target="_blank" class="btn">HMDB04043</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36086" target="_blank" class="btn">HMDB36086</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04472" target="_blank" class="btn">HMDB04472</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB05812" target="_blank" class="btn">HMDB05812</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35861" target="_blank" class="btn">HMDB35861</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38025" target="_blank" class="btn">HMDB38025</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37049" target="_blank" class="btn">HMDB37049</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31410" target="_blank" class="btn">HMDB31410</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41034" target="_blank" class="btn">HMDB41034</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35815" target="_blank" class="btn">HMDB35815</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35819" target="_blank" class="btn">HMDB35819</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36126" target="_blank" class="btn">HMDB36126</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36112" target="_blank" class="btn">HMDB36112</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37047" target="_blank" class="btn">HMDB37047</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36196" target="_blank" class="btn">HMDB36196</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35955" target="_blank" class="btn">HMDB35955</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36068" target="_blank" class="btn">HMDB36068</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34976" target="_blank" class="btn">HMDB34976</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35818" target="_blank" class="btn">HMDB35818</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36077" target="_blank" class="btn">HMDB36077</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37019" target="_blank" class="btn">HMDB37019</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34848" target="_blank" class="btn">HMDB34848</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35820" target="_blank" class="btn">HMDB35820</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35842" target="_blank" class="btn">HMDB35842</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35954" target="_blank" class="btn">HMDB35954</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37016" target="_blank" class="btn">HMDB37016</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35783" target="_blank" class="btn">HMDB35783</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35825" target="_blank" class="btn">HMDB35825</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37048" target="_blank" class="btn">HMDB37048</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36096" target="_blank" class="btn">HMDB36096</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37133" target="_blank" class="btn">HMDB37133</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36097" target="_blank" class="btn">HMDB36097</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36993" target="_blank" class="btn">HMDB36993</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36991" target="_blank" class="btn">HMDB36991</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37007" target="_blank" class="btn">HMDB37007</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35841" target="_blank" class="btn">HMDB35841</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32118" target="_blank" class="btn">HMDB32118</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36100" target="_blank" class="btn">HMDB36100</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37006" target="_blank" class="btn">HMDB37006</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35823" target="_blank" class="btn">HMDB35823</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37161" target="_blank" class="btn">HMDB37161</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37215" target="_blank" class="btn">HMDB37215</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41014" target="_blank" class="btn">HMDB41014</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35155" target="_blank" class="btn">HMDB35155</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36996" target="_blank" class="btn">HMDB36996</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30999" target="_blank" class="btn">HMDB30999</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36101" target="_blank" class="btn">HMDB36101</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36102" target="_blank" class="btn">HMDB36102</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36107" target="_blank" class="btn">HMDB36107</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36041" target="_blank" class="btn">HMDB36041</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34972" target="_blank" class="btn">HMDB34972</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40448" target="_blank" class="btn">HMDB40448</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37214" target="_blank" class="btn">HMDB37214</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34969" target="_blank" class="btn">HMDB34969</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36078" target="_blank" class="btn">HMDB36078</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38185" target="_blank" class="btn">HMDB38185</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35838" target="_blank" class="btn">HMDB35838</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35162" target="_blank" class="btn">HMDB35162</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34932" target="_blank" class="btn">HMDB34932</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35272" target="_blank" class="btn">HMDB35272</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35833" target="_blank" class="btn">HMDB35833</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32530" target="_blank" class="btn">HMDB32530</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59881" target="_blank" class="btn">HMDB59881</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59864" target="_blank" class="btn">HMDB59864</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59869" target="_blank" class="btn">HMDB59869</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61802" target="_blank" class="btn">HMDB61802</a></td><td class="ca">C10H18O</td><td class="ca">154.135765198</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.190875</td><td class="ca">0.000875</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01422" target="_blank" class="btn">HMDB01422</a></td><td class="ca">C9H21N2O3</td><td class="ca">205.155217548</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.188707</td><td class="ca">0.001293</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30326" target="_blank" class="btn">HMDB30326</a></td><td class="ca">C9H17NO</td><td class="ca">155.131014171</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.191384</td><td class="ca">0.001384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31179" target="_blank" class="btn">HMDB31179</a></td><td class="ca">C9H17NO</td><td class="ca">155.131014171</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.191384</td><td class="ca">0.001384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39833" target="_blank" class="btn">HMDB39833</a></td><td class="ca">C9H17NO</td><td class="ca">155.131014171</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.191384</td><td class="ca">0.001384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39834" target="_blank" class="btn">HMDB39834</a></td><td class="ca">C9H17NO</td><td class="ca">155.131014171</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.191384</td><td class="ca">0.001384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14888" target="_blank" class="btn">HMDB14888</a></td><td class="ca">C13H20N2O</td><td class="ca">220.157563272</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.191386</td><td class="ca">0.001386</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14362" target="_blank" class="btn">HMDB14362</a></td><td class="ca">C10H15N3</td><td class="ca">177.126597495</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.191937</td><td class="ca">0.001937</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30898" target="_blank" class="btn">HMDB30898</a></td><td class="ca">C28H40O</td><td class="ca">392.307915902</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.187781</td><td class="ca">0.002219</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40385" target="_blank" class="btn">HMDB40385</a></td><td class="ca">C39H41NO9</td><td class="ca">667.278131915</td><td class="ca">M+H+2Na</td><td class="ca">+</td><td class="ca">238.192234</td><td class="ca">0.002234</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39692" target="_blank" class="btn">HMDB39692</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34644" target="_blank" class="btn">HMDB34644</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34683" target="_blank" class="btn">HMDB34683</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34505" target="_blank" class="btn">HMDB34505</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35326" target="_blank" class="btn">HMDB35326</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34528" target="_blank" class="btn">HMDB34528</a></td><td class="ca">C30H50O4</td><td class="ca">474.370910088</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.192731</td><td class="ca">0.002731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15415" target="_blank" class="btn">HMDB15415</a></td><td class="ca">C12H21N5O3</td><td class="ca">283.164439563</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.19328</td><td class="ca">0.00328</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28890" target="_blank" class="btn">HMDB28890</a></td><td class="ca">C12H21N5O3</td><td class="ca">283.164439563</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.19328</td><td class="ca">0.00328</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28953" target="_blank" class="btn">HMDB28953</a></td><td class="ca">C12H21N5O3</td><td class="ca">283.164439563</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.19328</td><td class="ca">0.00328</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41845" target="_blank" class="btn">HMDB41845</a></td><td class="ca">C12H21N5O3</td><td class="ca">283.164439563</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.19328</td><td class="ca">0.00328</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12189" target="_blank" class="btn">HMDB12189</a></td><td class="ca">C8H21N3</td><td class="ca">159.173547687</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">238.194768</td><td class="ca">0.004768</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31506" target="_blank" class="btn">HMDB31506</a></td><td class="ca">C8H21N3</td><td class="ca">159.173547687</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">238.194768</td><td class="ca">0.004768</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34814" target="_blank" class="btn">HMDB34814</a></td><td class="ca">C30H54O</td><td class="ca">430.41746635</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.197951</td><td class="ca">0.007951</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04437" target="_blank" class="btn">HMDB04437</a></td><td class="ca">C4H11NO2</td><td class="ca">105.078978601</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">238.181077</td><td class="ca">0.008923</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34839" target="_blank" class="btn">HMDB34839</a></td><td class="ca">C31H48O2</td><td class="ca">452.36543078</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.180962</td><td class="ca">0.009038</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60502" target="_blank" class="btn">HMDB60502</a></td><td class="ca">C31H48O2</td><td class="ca">452.36543078</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.180962</td><td class="ca">0.009038</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35234" target="_blank" class="btn">HMDB35234</a></td><td class="ca">C29H56O2</td><td class="ca">436.428031036</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.199233</td><td class="ca">0.009233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37327" target="_blank" class="btn">HMDB37327</a></td><td class="ca">C29H56O2</td><td class="ca">436.428031036</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.199233</td><td class="ca">0.009233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35536" target="_blank" class="btn">HMDB35536</a></td><td class="ca">C29H56O2</td><td class="ca">436.428031036</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.199233</td><td class="ca">0.009233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35537" target="_blank" class="btn">HMDB35537</a></td><td class="ca">C29H56O2</td><td class="ca">436.428031036</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.199233</td><td class="ca">0.009233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37328" target="_blank" class="btn">HMDB37328</a></td><td class="ca">C29H56O2</td><td class="ca">436.428031036</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.199233</td><td class="ca">0.009233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14968" target="_blank" class="btn">HMDB14968</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40017" target="_blank" class="btn">HMDB40017</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39667" target="_blank" class="btn">HMDB39667</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33484" target="_blank" class="btn">HMDB33484</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39664" target="_blank" class="btn">HMDB39664</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40018" target="_blank" class="btn">HMDB40018</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40020" target="_blank" class="btn">HMDB40020</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40027" target="_blank" class="btn">HMDB40027</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40014" target="_blank" class="btn">HMDB40014</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40019" target="_blank" class="btn">HMDB40019</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41923" target="_blank" class="btn">HMDB41923</a></td><td class="ca">C11H15NO</td><td class="ca">177.115364107</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.180704</td><td class="ca">0.009296</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30273" target="_blank" class="btn">HMDB30273</a></td><td class="ca">C28H46N2O4</td><td class="ca">474.34575797</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.180155</td><td class="ca">0.009845</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00698" target="_blank" class="btn">HMDB00698</a></td><td class="ca">C26H43NO4</td><td class="ca">433.319208869</td><td class="ca">M+ACN+2H</td><td class="ca">+</td><td class="ca">238.180154</td><td class="ca">0.009846</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15072" target="_blank" class="btn">HMDB15072</a></td><td class="ca">C13H19NO</td><td class="ca">205.146664235</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00946" target="_blank" class="btn">HMDB00946</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03315" target="_blank" class="btn">HMDB03315</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00348" target="_blank" class="btn">HMDB00348</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00361" target="_blank" class="btn">HMDB00361</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00384" target="_blank" class="btn">HMDB00384</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00411" target="_blank" class="btn">HMDB00411</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00438" target="_blank" class="btn">HMDB00438</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00478" target="_blank" class="btn">HMDB00478</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00514" target="_blank" class="btn">HMDB00514</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00518" target="_blank" class="btn">HMDB00518</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00626" target="_blank" class="btn">HMDB00626</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00664" target="_blank" class="btn">HMDB00664</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00686" target="_blank" class="btn">HMDB00686</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00733" target="_blank" class="btn">HMDB00733</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00811" target="_blank" class="btn">HMDB00811</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02451" target="_blank" class="btn">HMDB02451</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02488" target="_blank" class="btn">HMDB02488</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02536" target="_blank" class="btn">HMDB02536</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02585" target="_blank" class="btn">HMDB02585</a></td><td class="ca">C24H40O4</td><td class="ca">392.292659768</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32901" target="_blank" class="btn">HMDB32901</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31692" target="_blank" class="btn">HMDB31692</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31030" target="_blank" class="btn">HMDB31030</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36599" target="_blank" class="btn">HMDB36599</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34903" target="_blank" class="btn">HMDB34903</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39539" target="_blank" class="btn">HMDB39539</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38996" target="_blank" class="btn">HMDB38996</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37606" target="_blank" class="btn">HMDB37606</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31563" target="_blank" class="btn">HMDB31563</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38280" target="_blank" class="btn">HMDB38280</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41469" target="_blank" class="btn">HMDB41469</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30332" target="_blank" class="btn">HMDB30332</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32193" target="_blank" class="btn">HMDB32193</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40277" target="_blank" class="btn">HMDB40277</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35157" target="_blank" class="btn">HMDB35157</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36389" target="_blank" class="btn">HMDB36389</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40206" target="_blank" class="btn">HMDB40206</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31564" target="_blank" class="btn">HMDB31564</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29728" target="_blank" class="btn">HMDB29728</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40217" target="_blank" class="btn">HMDB40217</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40226" target="_blank" class="btn">HMDB40226</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30867" target="_blank" class="btn">HMDB30867</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38270" target="_blank" class="btn">HMDB38270</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30945" target="_blank" class="btn">HMDB30945</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33714" target="_blank" class="btn">HMDB33714</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33549" target="_blank" class="btn">HMDB33549</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31498" target="_blank" class="btn">HMDB31498</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31497" target="_blank" class="btn">HMDB31497</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31196" target="_blank" class="btn">HMDB31196</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39522" target="_blank" class="btn">HMDB39522</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40725" target="_blank" class="btn">HMDB40725</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13817" target="_blank" class="btn">HMDB13817</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29721" target="_blank" class="btn">HMDB29721</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37718" target="_blank" class="btn">HMDB37718</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31496" target="_blank" class="btn">HMDB31496</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31541" target="_blank" class="btn">HMDB31541</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36048" target="_blank" class="btn">HMDB36048</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40397" target="_blank" class="btn">HMDB40397</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32051" target="_blank" class="btn">HMDB32051</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35239" target="_blank" class="btn">HMDB35239</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41494" target="_blank" class="btn">HMDB41494</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40264" target="_blank" class="btn">HMDB40264</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37714" target="_blank" class="btn">HMDB37714</a></td><td class="ca">C14H20O2</td><td class="ca">220.146329884</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40278" target="_blank" class="btn">HMDB40278</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40227" target="_blank" class="btn">HMDB40227</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37301" target="_blank" class="btn">HMDB37301</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61891" target="_blank" class="btn">HMDB61891</a></td><td class="ca">C7H10O</td><td class="ca">110.073164942</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40271" target="_blank" class="btn">HMDB40271</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32331" target="_blank" class="btn">HMDB32331</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62144" target="_blank" class="btn">HMDB62144</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60843" target="_blank" class="btn">HMDB60843</a></td><td class="ca">C13H19NO</td><td class="ca">205.146664235</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61816" target="_blank" class="btn">HMDB61816</a></td><td class="ca">C12H20O2</td><td class="ca">196.146329884</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62031" target="_blank" class="btn">HMDB62031</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62127" target="_blank" class="btn">HMDB62127</a></td><td class="ca">C6H10O</td><td class="ca">98.073164942</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.180153</td><td class="ca">0.009847</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB07895" target="_blank" class="btn">HMDB07895</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08917" target="_blank" class="btn">HMDB08917</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11203" target="_blank" class="btn">HMDB11203</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11370" target="_blank" class="btn">HMDB11370</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13402" target="_blank" class="btn">HMDB13402</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13403" target="_blank" class="btn">HMDB13403</a></td><td class="ca">C38H76NO7P</td><td class="ca">689.535940303</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.179903</td><td class="ca">0.010097</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01893" target="_blank" class="btn">HMDB01893</a></td><td class="ca">C29H50O2</td><td class="ca">430.381080844</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.179758</td><td class="ca">0.010242</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12171" target="_blank" class="btn">HMDB12171</a></td><td class="ca">C29H50O2</td><td class="ca">430.381080844</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.179758</td><td class="ca">0.010242</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30022" target="_blank" class="btn">HMDB30022</a></td><td class="ca">C29H50O2</td><td class="ca">430.381080844</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.179758</td><td class="ca">0.010242</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59642" target="_blank" class="btn">HMDB59642</a></td><td class="ca">C29H50O2</td><td class="ca">430.381080844</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.179758</td><td class="ca">0.010242</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37163" target="_blank" class="btn">HMDB37163</a></td><td class="ca">C11H24O4</td><td class="ca">220.167459256</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.201282</td><td class="ca">0.011282</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30083" target="_blank" class="btn">HMDB30083</a></td><td class="ca">C10H22O2</td><td class="ca">174.161979948</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.177745</td><td class="ca">0.012255</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37639" target="_blank" class="btn">HMDB37639</a></td><td class="ca">C10H22O2</td><td class="ca">174.161979948</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.177745</td><td class="ca">0.012255</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40267" target="_blank" class="btn">HMDB40267</a></td><td class="ca">C10H22O2</td><td class="ca">174.161979948</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.177745</td><td class="ca">0.012255</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61936" target="_blank" class="btn">HMDB61936</a></td><td class="ca">C10H22O2</td><td class="ca">174.161979948</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.177745</td><td class="ca">0.012255</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37787" target="_blank" class="btn">HMDB37787</a></td><td class="ca">C5H10N2</td><td class="ca">98.08439833</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">238.20262</td><td class="ca">0.01262</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01009" target="_blank" class="btn">HMDB01009</a></td><td class="ca">C11H17N2</td><td class="ca">177.139173554</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.204514</td><td class="ca">0.014514</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35144" target="_blank" class="btn">HMDB35144</a></td><td class="ca">C29H46O5</td><td class="ca">474.334524582</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.174538</td><td class="ca">0.015462</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35221" target="_blank" class="btn">HMDB35221</a></td><td class="ca">C29H46O5</td><td class="ca">474.334524582</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.174538</td><td class="ca">0.015462</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00483" target="_blank" class="btn">HMDB00483</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00513" target="_blank" class="btn">HMDB00513</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00556" target="_blank" class="btn">HMDB00556</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00558" target="_blank" class="btn">HMDB00558</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02180" target="_blank" class="btn">HMDB02180</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02208" target="_blank" class="btn">HMDB02208</a></td><td class="ca">C27H48O5</td><td class="ca">452.350174646</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.173334</td><td class="ca">0.016666</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60994" target="_blank" class="btn">HMDB60994</a></td><td class="ca">C15H25NO4</td><td class="ca">283.178358293</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.207198</td><td class="ca">0.017198</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39019" target="_blank" class="btn">HMDB39019</a></td><td class="ca">C27H36O2</td><td class="ca">392.271530396</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.169588</td><td class="ca">0.020412</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08838" target="_blank" class="btn">HMDB08838</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08839" target="_blank" class="btn">HMDB08839</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08870" target="_blank" class="btn">HMDB08870</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08869" target="_blank" class="btn">HMDB08869</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08931" target="_blank" class="btn">HMDB08931</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08963" target="_blank" class="btn">HMDB08963</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08962" target="_blank" class="btn">HMDB08962</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09122" target="_blank" class="btn">HMDB09122</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09155" target="_blank" class="btn">HMDB09155</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09187" target="_blank" class="btn">HMDB09187</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09317" target="_blank" class="btn">HMDB09317</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09350" target="_blank" class="btn">HMDB09350</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09382" target="_blank" class="btn">HMDB09382</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09415" target="_blank" class="btn">HMDB09415</a></td><td class="ca">C39H70NO8P</td><td class="ca">711.483904733</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.168578</td><td class="ca">0.021422</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB07901" target="_blank" class="btn">HMDB07901</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.499554797</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB07933" target="_blank" class="btn">HMDB07933</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.499554797</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08827" target="_blank" class="btn">HMDB08827</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08828" target="_blank" class="btn">HMDB08828</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08859" target="_blank" class="btn">HMDB08859</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.499554797</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08924" target="_blank" class="btn">HMDB08924</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08956" target="_blank" class="btn">HMDB08956</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08987" target="_blank" class="btn">HMDB08987</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.499554797</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09019" target="_blank" class="btn">HMDB09019</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB09052" target="_blank" class="btn">HMDB09052</a></td><td class="ca">C37H72NO8P</td><td class="ca">689.49955528</td><td class="ca">M+2H+Na</td><td class="ca">+</td><td class="ca">238.167775</td><td class="ca">0.022225</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15050" target="_blank" class="btn">HMDB15050</a></td><td class="ca">C10H15N5</td><td class="ca">205.132745505</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.166235</td><td class="ca">0.023765</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35360" target="_blank" class="btn">HMDB35360</a></td><td class="ca">C7H15NO4</td><td class="ca">177.100107973</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.165448</td><td class="ca">0.024552</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29936" target="_blank" class="btn">HMDB29936</a></td><td class="ca">C9H20NO2</td><td class="ca">174.149403889</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.165169</td><td class="ca">0.024831</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13223" target="_blank" class="btn">HMDB13223</a></td><td class="ca">C9H20NO2</td><td class="ca">174.149403889</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.165169</td><td class="ca">0.024831</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04231" target="_blank" class="btn">HMDB04231</a></td><td class="ca">C9H19NO4</td><td class="ca">205.131408101</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.164897</td><td class="ca">0.025103</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35645" target="_blank" class="btn">HMDB35645</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37395" target="_blank" class="btn">HMDB37395</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35720" target="_blank" class="btn">HMDB35720</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39711" target="_blank" class="btn">HMDB39711</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36118" target="_blank" class="btn">HMDB36118</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35306" target="_blank" class="btn">HMDB35306</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34940" target="_blank" class="btn">HMDB34940</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30232" target="_blank" class="btn">HMDB30232</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36793" target="_blank" class="btn">HMDB36793</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35097" target="_blank" class="btn">HMDB35097</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36789" target="_blank" class="btn">HMDB36789</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35020" target="_blank" class="btn">HMDB35020</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41490" target="_blank" class="btn">HMDB41490</a></td><td class="ca">C13H24O</td><td class="ca">196.18271539</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40763" target="_blank" class="btn">HMDB40763</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38209" target="_blank" class="btn">HMDB38209</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33826" target="_blank" class="btn">HMDB33826</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38123" target="_blank" class="btn">HMDB38123</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38134" target="_blank" class="btn">HMDB38134</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39532" target="_blank" class="btn">HMDB39532</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35718" target="_blank" class="btn">HMDB35718</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38193" target="_blank" class="btn">HMDB38193</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36717" target="_blank" class="btn">HMDB36717</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38208" target="_blank" class="btn">HMDB38208</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36788" target="_blank" class="btn">HMDB36788</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38160" target="_blank" class="btn">HMDB38160</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35704" target="_blank" class="btn">HMDB35704</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37069" target="_blank" class="btn">HMDB37069</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35026" target="_blank" class="btn">HMDB35026</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35793" target="_blank" class="btn">HMDB35793</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38212" target="_blank" class="btn">HMDB38212</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35739" target="_blank" class="btn">HMDB35739</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38146" target="_blank" class="btn">HMDB38146</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36420" target="_blank" class="btn">HMDB36420</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36798" target="_blank" class="btn">HMDB36798</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36402" target="_blank" class="btn">HMDB36402</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36192" target="_blank" class="btn">HMDB36192</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38119" target="_blank" class="btn">HMDB38119</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37275" target="_blank" class="btn">HMDB37275</a></td><td class="ca">C13H24O</td><td class="ca">196.18271539</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38982" target="_blank" class="btn">HMDB38982</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37392" target="_blank" class="btn">HMDB37392</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60356" target="_blank" class="btn">HMDB60356</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34718" target="_blank" class="btn">HMDB34718</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34661" target="_blank" class="btn">HMDB34661</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38211" target="_blank" class="btn">HMDB38211</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41404" target="_blank" class="btn">HMDB41404</a></td><td class="ca">C13H24O</td><td class="ca">196.18271539</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36716" target="_blank" class="btn">HMDB36716</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38512" target="_blank" class="btn">HMDB38512</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35391" target="_blank" class="btn">HMDB35391</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36172" target="_blank" class="btn">HMDB36172</a></td><td class="ca">C13H24O</td><td class="ca">196.18271539</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38210" target="_blank" class="btn">HMDB38210</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32220" target="_blank" class="btn">HMDB32220</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32247" target="_blank" class="btn">HMDB32247</a></td><td class="ca">C13H24O</td><td class="ca">196.18271539</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37811" target="_blank" class="btn">HMDB37811</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13688" target="_blank" class="btn">HMDB13688</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59836" target="_blank" class="btn">HMDB59836</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60295" target="_blank" class="btn">HMDB60295</a></td><td class="ca">C15H24O</td><td class="ca">220.18271539</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.216538</td><td class="ca">0.026538</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00520" target="_blank" class="btn">HMDB00520</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00524" target="_blank" class="btn">HMDB00524</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00655" target="_blank" class="btn">HMDB00655</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01231" target="_blank" class="btn">HMDB01231</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01968" target="_blank" class="btn">HMDB01968</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29851" target="_blank" class="btn">HMDB29851</a></td><td class="ca">C27H48O4</td><td class="ca">436.355260024</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.162847</td><td class="ca">0.027153</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35888" target="_blank" class="btn">HMDB35888</a></td><td class="ca">C30H44O3</td><td class="ca">452.329045274</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.16277</td><td class="ca">0.02723</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37065" target="_blank" class="btn">HMDB37065</a></td><td class="ca">C30H44O3</td><td class="ca">452.329045274</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.16277</td><td class="ca">0.02723</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29993" target="_blank" class="btn">HMDB29993</a></td><td class="ca">C30H60O</td><td class="ca">436.464416542</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.217425</td><td class="ca">0.027425</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30296" target="_blank" class="btn">HMDB30296</a></td><td class="ca">C30H60O</td><td class="ca">436.464416542</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.217425</td><td class="ca">0.027425</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32868" target="_blank" class="btn">HMDB32868</a></td><td class="ca">C30H60O</td><td class="ca">436.464416542</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.217425</td><td class="ca">0.027425</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60730" target="_blank" class="btn">HMDB60730</a></td><td class="ca">C23H36O5</td><td class="ca">392.256274262</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.16196</td><td class="ca">0.02804</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12166" target="_blank" class="btn">HMDB12166</a></td><td class="ca">C28H46O3</td><td class="ca">430.344695338</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.161566</td><td class="ca">0.028434</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37914" target="_blank" class="btn">HMDB37914</a></td><td class="ca">C28H46O3</td><td class="ca">430.344695338</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.161566</td><td class="ca">0.028434</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38353" target="_blank" class="btn">HMDB38353</a></td><td class="ca">C28H46O3</td><td class="ca">430.344695338</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.161566</td><td class="ca">0.028434</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35513" target="_blank" class="btn">HMDB35513</a></td><td class="ca">C28H46O3</td><td class="ca">430.344695338</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.161566</td><td class="ca">0.028434</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB10701" target="_blank" class="btn">HMDB10701</a></td><td class="ca">C36H72NO6P</td><td class="ca">645.509725553</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">238.159127</td><td class="ca">0.030873</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38163" target="_blank" class="btn">HMDB38163</a></td><td class="ca">C15H16</td><td class="ca">196.125200512</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.159024</td><td class="ca">0.030976</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32564" target="_blank" class="btn">HMDB32564</a></td><td class="ca">C15H16</td><td class="ca">196.125200512</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.159024</td><td class="ca">0.030976</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38162" target="_blank" class="btn">HMDB38162</a></td><td class="ca">C15H16</td><td class="ca">196.125200512</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.159024</td><td class="ca">0.030976</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14647" target="_blank" class="btn">HMDB14647</a></td><td class="ca">C19H25NO</td><td class="ca">283.193614427</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.222454</td><td class="ca">0.032454</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13972" target="_blank" class="btn">HMDB13972</a></td><td class="ca">C19H25NO</td><td class="ca">283.193614427</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.222454</td><td class="ca">0.032454</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28799" target="_blank" class="btn">HMDB28799</a></td><td class="ca">C11H17N5O4</td><td class="ca">283.128054057</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.156894</td><td class="ca">0.033106</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29151" target="_blank" class="btn">HMDB29151</a></td><td class="ca">C11H17N5O4</td><td class="ca">283.128054057</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.156894</td><td class="ca">0.033106</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28883" target="_blank" class="btn">HMDB28883</a></td><td class="ca">C11H17N5O4</td><td class="ca">283.128054057</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.156894</td><td class="ca">0.033106</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28899" target="_blank" class="btn">HMDB28899</a></td><td class="ca">C11H17N5O4</td><td class="ca">283.128054057</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.156894</td><td class="ca">0.033106</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15508" target="_blank" class="btn">HMDB15508</a></td><td class="ca">C15H21N</td><td class="ca">215.167399677</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">238.156618</td><td class="ca">0.033382</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36683" target="_blank" class="btn">HMDB36683</a></td><td class="ca">C13H18</td><td class="ca">174.140850576</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.156616</td><td class="ca">0.033384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59826" target="_blank" class="btn">HMDB59826</a></td><td class="ca">C13H18</td><td class="ca">174.140850576</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.156616</td><td class="ca">0.033384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59696" target="_blank" class="btn">HMDB59696</a></td><td class="ca">C13H18</td><td class="ca">174.140850576</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.156616</td><td class="ca">0.033384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61824" target="_blank" class="btn">HMDB61824</a></td><td class="ca">C13H18</td><td class="ca">174.140850576</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.156616</td><td class="ca">0.033384</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30085" target="_blank" class="btn">HMDB30085</a></td><td class="ca">C28H42O6</td><td class="ca">474.298139076</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">238.156346</td><td class="ca">0.033654</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60061" target="_blank" class="btn">HMDB60061</a></td><td class="ca">C16H34NO5P</td><td class="ca">351.217459715</td><td class="ca">M+3ACN+2H</td><td class="ca">+</td><td class="ca">238.155827</td><td class="ca">0.034173</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41940" target="_blank" class="btn">HMDB41940</a></td><td class="ca">C9H11N3O</td><td class="ca">177.090211989</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.155552</td><td class="ca">0.034448</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29741" target="_blank" class="btn">HMDB29741</a></td><td class="ca">C10H16N2O2</td><td class="ca">196.121177766</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.155001</td><td class="ca">0.034999</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40551" target="_blank" class="btn">HMDB40551</a></td><td class="ca">C10H16N2O2</td><td class="ca">196.121177766</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.155001</td><td class="ca">0.034999</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30353" target="_blank" class="btn">HMDB30353</a></td><td class="ca">C8H13NO2</td><td class="ca">155.094628665</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.154999</td><td class="ca">0.035001</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62098" target="_blank" class="btn">HMDB62098</a></td><td class="ca">C8H13NO2</td><td class="ca">155.094628663</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.154999</td><td class="ca">0.035001</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31659" target="_blank" class="btn">HMDB31659</a></td><td class="ca">C5H13N</td><td class="ca">87.104799421</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.225364</td><td class="ca">0.035364</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32392" target="_blank" class="btn">HMDB32392</a></td><td class="ca">C5H13N</td><td class="ca">87.104799421</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.225364</td><td class="ca">0.035364</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31202" target="_blank" class="btn">HMDB31202</a></td><td class="ca">C12H29N3</td><td class="ca">215.236147943</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">238.225366</td><td class="ca">0.035366</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35135" target="_blank" class="btn">HMDB35135</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38697" target="_blank" class="btn">HMDB38697</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38268" target="_blank" class="btn">HMDB38268</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31302" target="_blank" class="btn">HMDB31302</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37276" target="_blank" class="btn">HMDB37276</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36177" target="_blank" class="btn">HMDB36177</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36239" target="_blank" class="btn">HMDB36239</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40285" target="_blank" class="btn">HMDB40285</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32314" target="_blank" class="btn">HMDB32314</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32442" target="_blank" class="btn">HMDB32442</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60285" target="_blank" class="btn">HMDB60285</a></td><td class="ca">C9H14O2</td><td class="ca">154.099379692</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.15449</td><td class="ca">0.03551</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29888" target="_blank" class="btn">HMDB29888</a></td><td class="ca">C24H46O6</td><td class="ca">430.329439204</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.153938</td><td class="ca">0.036062</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29551" target="_blank" class="btn">HMDB29551</a></td><td class="ca">C11H22</td><td class="ca">154.172150704</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.227261</td><td class="ca">0.037261</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31205" target="_blank" class="btn">HMDB31205</a></td><td class="ca">C11H22</td><td class="ca">154.172150704</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.227261</td><td class="ca">0.037261</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61812" target="_blank" class="btn">HMDB61812</a></td><td class="ca">C11H22</td><td class="ca">154.172150704</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.227261</td><td class="ca">0.037261</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62070" target="_blank" class="btn">HMDB62070</a></td><td class="ca">C11H22</td><td class="ca">154.172150708</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">238.227261</td><td class="ca">0.037261</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60817" target="_blank" class="btn">HMDB60817</a></td><td class="ca">C10H21N3O2</td><td class="ca">215.163376931</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">238.152595</td><td class="ca">0.037405</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33870" target="_blank" class="btn">HMDB33870</a></td><td class="ca">C4H9NO</td><td class="ca">87.068413915</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01080" target="_blank" class="btn">HMDB01080</a></td><td class="ca">C4H9NO</td><td class="ca">87.068413915</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60247" target="_blank" class="btn">HMDB60247</a></td><td class="ca">C4H9NO</td><td class="ca">87.068413915</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31581" target="_blank" class="btn">HMDB31581</a></td><td class="ca">C4H9NO</td><td class="ca">87.068413915</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31215" target="_blank" class="btn">HMDB31215</a></td><td class="ca">C4H9NO</td><td class="ca">87.068413915</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13287" target="_blank" class="btn">HMDB13287</a></td><td class="ca">C8H18N2O2</td><td class="ca">174.13682783</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.152593</td><td class="ca">0.037407</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04649" target="_blank" class="btn">HMDB04649</a></td><td class="ca">C30H44O2</td><td class="ca">436.334130652</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.152282</td><td class="ca">0.037718</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35983" target="_blank" class="btn">HMDB35983</a></td><td class="ca">C30H44O2</td><td class="ca">436.334130652</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.152282</td><td class="ca">0.037718</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30395" target="_blank" class="btn">HMDB30395</a></td><td class="ca">C30H44O2</td><td class="ca">436.334130652</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.152282</td><td class="ca">0.037718</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15659" target="_blank" class="btn">HMDB15659</a></td><td class="ca">C10H21N</td><td class="ca">155.167399677</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.22777</td><td class="ca">0.03777</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32350" target="_blank" class="btn">HMDB32350</a></td><td class="ca">C10H21N</td><td class="ca">155.167399677</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">238.22777</td><td class="ca">0.03777</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29987" target="_blank" class="btn">HMDB29987</a></td><td class="ca">C30H60O2</td><td class="ca">452.459331164</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.227913</td><td class="ca">0.037913</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30925" target="_blank" class="btn">HMDB30925</a></td><td class="ca">C30H60O2</td><td class="ca">452.459331164</td><td class="ca">M+H+Na</td><td class="ca">+</td><td class="ca">238.227913</td><td class="ca">0.037913</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31977" target="_blank" class="btn">HMDB31977</a></td><td class="ca">C26H32O3</td><td class="ca">392.23514489</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.151395</td><td class="ca">0.038605</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35640" target="_blank" class="btn">HMDB35640</a></td><td class="ca">C31H42O</td><td class="ca">430.323565966</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.151001</td><td class="ca">0.038999</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB07003" target="_blank" class="btn">HMDB07003</a></td><td class="ca">C19H37O6P</td><td class="ca">392.232775428</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.150211</td><td class="ca">0.039789</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02372" target="_blank" class="btn">HMDB02372</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03563" target="_blank" class="btn">HMDB03563</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30191" target="_blank" class="btn">HMDB30191</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39521" target="_blank" class="btn">HMDB39521</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34669" target="_blank" class="btn">HMDB34669</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32845" target="_blank" class="btn">HMDB32845</a></td><td class="ca">C17H17NO3</td><td class="ca">283.120843415</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.149683</td><td class="ca">0.040317</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14592" target="_blank" class="btn">HMDB14592</a></td><td class="ca">C19H29NO5</td><td class="ca">351.204573043</td><td class="ca">M+3ACN+2H</td><td class="ca">+</td><td class="ca">238.149384</td><td class="ca">0.040616</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35472" target="_blank" class="btn">HMDB35472</a></td><td class="ca">C44H89NO5</td><td class="ca">711.674074963</td><td class="ca">M+3H</td><td class="ca">+</td><td class="ca">238.231968</td><td class="ca">0.041968</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14375" target="_blank" class="btn">HMDB14375</a></td><td class="ca">C8H17NO2</td><td class="ca">159.125928793</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">238.147149</td><td class="ca">0.042851</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00991" target="_blank" class="btn">HMDB00991</a></td><td class="ca">C8H17NO2</td><td class="ca">159.125928793</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">238.147149</td><td class="ca">0.042851</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59796" target="_blank" class="btn">HMDB59796</a></td><td class="ca">C29H57N5O12</td><td class="ca">667.400372313</td><td class="ca">M+H+2Na</td><td class="ca">+</td><td class="ca">238.232981</td><td class="ca">0.042981</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB08883" target="_blank" class="btn">HMDB08883</a></td><td class="ca">C35H68NO7P</td><td class="ca">645.473340047</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">238.146998</td><td class="ca">0.043002</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11336" target="_blank" class="btn">HMDB11336</a></td><td class="ca">C35H68NO7P</td><td class="ca">645.473340047</td><td class="ca">M+3Na</td><td class="ca">+</td><td class="ca">238.146998</td><td class="ca">0.043002</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12501" target="_blank" class="btn">HMDB12501</a></td><td class="ca">C23H39NO6S</td><td class="ca">457.249808675</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">238.145454</td><td class="ca">0.044546</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29802" target="_blank" class="btn">HMDB29802</a></td><td class="ca">C27H52O</td><td class="ca">392.401816286</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.234731</td><td class="ca">0.044731</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14354" target="_blank" class="btn">HMDB14354</a></td><td class="ca">C25H30NO3</td><td class="ca">392.222568831</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.145107</td><td class="ca">0.044893</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02195" target="_blank" class="btn">HMDB02195</a></td><td class="ca">C26H44O5</td><td class="ca">436.318874518</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.144654</td><td class="ca">0.045346</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30092" target="_blank" class="btn">HMDB30092</a></td><td class="ca">C31H64</td><td class="ca">436.500802048</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">238.235618</td><td class="ca">0.045618</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01855" target="_blank" class="btn">HMDB01855</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33482" target="_blank" class="btn">HMDB33482</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37693" target="_blank" class="btn">HMDB37693</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40045" target="_blank" class="btn">HMDB40045</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12490" target="_blank" class="btn">HMDB12490</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60063" target="_blank" class="btn">HMDB60063</a></td><td class="ca">C10H11NO2</td><td class="ca">177.078978601</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.144319</td><td class="ca">0.045681</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40046" target="_blank" class="btn">HMDB40046</a></td><td class="ca">C12H15NO2</td><td class="ca">205.110278729</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">238.143768</td><td class="ca">0.046232</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32589" target="_blank" class="btn">HMDB32589</a></td><td class="ca">C13H16O3</td><td class="ca">220.109944378</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36226" target="_blank" class="btn">HMDB36226</a></td><td class="ca">C11H16O3</td><td class="ca">196.109944378</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37734" target="_blank" class="btn">HMDB37734</a></td><td class="ca">C11H16O3</td><td class="ca">196.109944378</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37492" target="_blank" class="btn">HMDB37492</a></td><td class="ca">C13H16O3</td><td class="ca">220.109944378</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40424" target="_blank" class="btn">HMDB40424</a></td><td class="ca">C13H16O3</td><td class="ca">220.109944378</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34662" target="_blank" class="btn">HMDB34662</a></td><td class="ca">C22H32O6</td><td class="ca">392.219888756</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37725" target="_blank" class="btn">HMDB37725</a></td><td class="ca">C11H16O3</td><td class="ca">196.109944378</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61823" target="_blank" class="btn">HMDB61823</a></td><td class="ca">C13H16O3</td><td class="ca">220.109944378</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61942" target="_blank" class="btn">HMDB61942</a></td><td class="ca">C13H16O3</td><td class="ca">220.109944378</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">238.143767</td><td class="ca">0.046233</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11560" target="_blank" class="btn">HMDB11560</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11590" target="_blank" class="btn">HMDB11590</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12458" target="_blank" class="btn">HMDB12458</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34403" target="_blank" class="btn">HMDB34403</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36249" target="_blank" class="btn">HMDB36249</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30066" target="_blank" class="btn">HMDB30066</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60127" target="_blank" class="btn">HMDB60127</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60128" target="_blank" class="btn">HMDB60128</a></td><td class="ca">C27H42O4</td><td class="ca">430.308309832</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">238.143373</td><td class="ca">0.046627</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13279" target="_blank" class="btn">HMDB13279</a></td><td class="ca">C11H21NO3</td><td class="ca">215.152143543</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">238.141362</td><td class="ca">0.048638</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34040" target="_blank" class="btn">HMDB34040</a></td><td class="ca">C9H18O3</td><td class="ca">174.125594442</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.141359</td><td class="ca">0.048641</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31513" target="_blank" class="btn">HMDB31513</a></td><td class="ca">C9H18O3</td><td class="ca">174.125594442</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">238.141359</td><td class="ca">0.048641</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41818" target="_blank" class="btn">HMDB41818</a></td><td class="ca">C16H14FN3O</td><td class="ca">283.11209029</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">238.14093</td><td class="ca">0.04907</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12271" target="_blank" class="btn">HMDB12271</a></td><td class="ca">C5H11N3O4</td><td class="ca">177.074955855</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">238.140296</td><td class="ca">0.049704</td></tr><tr class="white"><td class="ca" >mz_00003</td><td id="3" class="ca" >420.16</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60836" target="_blank" class="btn">HMDB60836</a></td><td class="ca">C17H17N3O4S</td><td class="ca">359.093976737</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.159317</td><td class="ca">0.000683</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60838" target="_blank" class="btn">HMDB60838</a></td><td class="ca">C17H17N3O4S</td><td class="ca">359.093976737</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.159317</td><td class="ca">0.000683</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33374" target="_blank" class="btn">HMDB33374</a></td><td class="ca">C16H19NO5S</td><td class="ca">337.098393413</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.158763</td><td class="ca">0.001237</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00590" target="_blank" class="btn">HMDB00590</a></td><td class="ca">C7H11NO5</td><td class="ca">189.063722467</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.161268</td><td class="ca">0.001268</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01138" target="_blank" class="btn">HMDB01138</a></td><td class="ca">C7H11NO5</td><td class="ca">189.063722467</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.161268</td><td class="ca">0.001268</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14535" target="_blank" class="btn">HMDB14535</a></td><td class="ca">C15H23N3O4S</td><td class="ca">341.140926929</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.162147</td><td class="ca">0.002147</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15135" target="_blank" class="btn">HMDB15135</a></td><td class="ca">C15H23N3O4S</td><td class="ca">341.140926929</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.162147</td><td class="ca">0.002147</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30384" target="_blank" class="btn">HMDB30384</a></td><td class="ca">C19H18ClNO4</td><td class="ca">359.092435776</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.157776</td><td class="ca">0.002224</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36989" target="_blank" class="btn">HMDB36989</a></td><td class="ca">C19H18ClNO4</td><td class="ca">359.092435776</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.157776</td><td class="ca">0.002224</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30189" target="_blank" class="btn">HMDB30189</a></td><td class="ca">C19H18ClNO4</td><td class="ca">359.092435776</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.157776</td><td class="ca">0.002224</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40341" target="_blank" class="btn">HMDB40341</a></td><td class="ca">C34H44O19</td><td class="ca">756.247679226</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.157663</td><td class="ca">0.002337</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40372" target="_blank" class="btn">HMDB40372</a></td><td class="ca">C34H44O19</td><td class="ca">756.247679226</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.157663</td><td class="ca">0.002337</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31695" target="_blank" class="btn">HMDB31695</a></td><td class="ca">C17H24O8</td><td class="ca">356.147117744</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.162883</td><td class="ca">0.002883</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40558" target="_blank" class="btn">HMDB40558</a></td><td class="ca">C17H24O8</td><td class="ca">356.147117744</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.162883</td><td class="ca">0.002883</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31574" target="_blank" class="btn">HMDB31574</a></td><td class="ca">C8H15NS2</td><td class="ca">189.064590865</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.163005</td><td class="ca">0.003005</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32499" target="_blank" class="btn">HMDB32499</a></td><td class="ca">C8H15NS2</td><td class="ca">189.064590865</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.163005</td><td class="ca">0.003005</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15253" target="_blank" class="btn">HMDB15253</a></td><td class="ca">C9H10N2O2</td><td class="ca">178.074227574</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.16422</td><td class="ca">0.00422</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01267" target="_blank" class="btn">HMDB01267</a></td><td class="ca">C9H10N2O2</td><td class="ca">178.074227574</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.16422</td><td class="ca">0.00422</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04145" target="_blank" class="btn">HMDB04145</a></td><td class="ca">C9H10N2O2</td><td class="ca">178.074227574</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.16422</td><td class="ca">0.00422</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04146" target="_blank" class="btn">HMDB04146</a></td><td class="ca">C9H10N2O2</td><td class="ca">178.074227574</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.16422</td><td class="ca">0.00422</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41452" target="_blank" class="btn">HMDB41452</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29533" target="_blank" class="btn">HMDB29533</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30141" target="_blank" class="btn">HMDB30141</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34027" target="_blank" class="btn">HMDB34027</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30450" target="_blank" class="btn">HMDB30450</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37922" target="_blank" class="btn">HMDB37922</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29791" target="_blank" class="btn">HMDB29791</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29787" target="_blank" class="btn">HMDB29787</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34050" target="_blank" class="btn">HMDB34050</a></td><td class="ca">C20H16O5</td><td class="ca">336.099773622</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.154884</td><td class="ca">0.005116</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04662" target="_blank" class="btn">HMDB04662</a></td><td class="ca">C11H19N3O7S</td><td class="ca">337.094370667</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.154741</td><td class="ca">0.005259</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39733" target="_blank" class="btn">HMDB39733</a></td><td class="ca">C11H19N3O7S</td><td class="ca">337.094370667</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.154741</td><td class="ca">0.005259</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31401" target="_blank" class="btn">HMDB31401</a></td><td class="ca">C20H21NO7</td><td class="ca">387.131802031</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35415" target="_blank" class="btn">HMDB35415</a></td><td class="ca">C21H22O8</td><td class="ca">402.13146768</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39137" target="_blank" class="btn">HMDB39137</a></td><td class="ca">C19H22O8</td><td class="ca">378.13146768</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35037" target="_blank" class="btn">HMDB35037</a></td><td class="ca">C19H22O8</td><td class="ca">378.13146768</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29308" target="_blank" class="btn">HMDB29308</a></td><td class="ca">C21H22O8</td><td class="ca">402.13146768</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37755" target="_blank" class="btn">HMDB37755</a></td><td class="ca">C21H22O8</td><td class="ca">402.13146768</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39379" target="_blank" class="btn">HMDB39379</a></td><td class="ca">C21H22O8</td><td class="ca">402.13146768</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29540" target="_blank" class="btn">HMDB29540</a></td><td class="ca">C21H22O8</td><td class="ca">402.13146768</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29304" target="_blank" class="btn">HMDB29304</a></td><td class="ca">C19H22O8</td><td class="ca">378.13146768</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.165291</td><td class="ca">0.005291</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33211" target="_blank" class="btn">HMDB33211</a></td><td class="ca">C18H17NO7</td><td class="ca">359.100501903</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.165842</td><td class="ca">0.005842</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39157" target="_blank" class="btn">HMDB39157</a></td><td class="ca">C18H17NO7</td><td class="ca">359.100501903</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.165842</td><td class="ca">0.005842</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29286" target="_blank" class="btn">HMDB29286</a></td><td class="ca">C18H17NO7</td><td class="ca">359.100501903</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.165842</td><td class="ca">0.005842</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06591" target="_blank" class="btn">HMDB06591</a></td><td class="ca">C12H23NO10</td><td class="ca">341.132195961</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.153416</td><td class="ca">0.006584</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11668" target="_blank" class="btn">HMDB11668</a></td><td class="ca">C12H23NO10</td><td class="ca">341.132195961</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.153416</td><td class="ca">0.006584</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33395" target="_blank" class="btn">HMDB33395</a></td><td class="ca">C39H50O20</td><td class="ca">838.28954404</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">420.152048</td><td class="ca">0.007952</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32864" target="_blank" class="btn">HMDB32864</a></td><td class="ca">C16H23NO7</td><td class="ca">341.147452095</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.168672</td><td class="ca">0.008672</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30934" target="_blank" class="btn">HMDB30934</a></td><td class="ca">C14H17NO10</td><td class="ca">359.085245769</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.150586</td><td class="ca">0.009414</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14502" target="_blank" class="btn">HMDB14502</a></td><td class="ca">C17H16F6N2O</td><td class="ca">378.116682374</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.150505</td><td class="ca">0.009495</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37265" target="_blank" class="btn">HMDB37265</a></td><td class="ca">C16H21NO10</td><td class="ca">387.116545897</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.150035</td><td class="ca">0.009965</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37262" target="_blank" class="btn">HMDB37262</a></td><td class="ca">C16H21NO10</td><td class="ca">387.116545897</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.150035</td><td class="ca">0.009965</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59971" target="_blank" class="btn">HMDB59971</a></td><td class="ca">C17H22O11</td><td class="ca">402.116211546</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.150035</td><td class="ca">0.009965</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59973" target="_blank" class="btn">HMDB59973</a></td><td class="ca">C17H22O11</td><td class="ca">402.116211546</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.150035</td><td class="ca">0.009965</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28896" target="_blank" class="btn">HMDB28896</a></td><td class="ca">C17H19N5O3</td><td class="ca">341.148789499</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.170009</td><td class="ca">0.010009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29085" target="_blank" class="btn">HMDB29085</a></td><td class="ca">C17H19N5O3</td><td class="ca">341.148789499</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.170009</td><td class="ca">0.010009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00434" target="_blank" class="btn">HMDB00434</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40256" target="_blank" class="btn">HMDB40256</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35721" target="_blank" class="btn">HMDB35721</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30571" target="_blank" class="btn">HMDB30571</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29648" target="_blank" class="btn">HMDB29648</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37177" target="_blank" class="btn">HMDB37177</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29645" target="_blank" class="btn">HMDB29645</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39427" target="_blank" class="btn">HMDB39427</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40637" target="_blank" class="btn">HMDB40637</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32365" target="_blank" class="btn">HMDB32365</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB62121" target="_blank" class="btn">HMDB62121</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60398" target="_blank" class="btn">HMDB60398</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60733" target="_blank" class="btn">HMDB60733</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60735" target="_blank" class="btn">HMDB60735</a></td><td class="ca">C10H12O4</td><td class="ca">196.073558872</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.170238</td><td class="ca">0.010238</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11739" target="_blank" class="btn">HMDB11739</a></td><td class="ca">C12H26O13</td><td class="ca">378.137340918</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.171164</td><td class="ca">0.011164</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33927" target="_blank" class="btn">HMDB33927</a></td><td class="ca">C12H20N2O9</td><td class="ca">336.116880248</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.17199</td><td class="ca">0.01199</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33187" target="_blank" class="btn">HMDB33187</a></td><td class="ca">C14H10</td><td class="ca">178.07825032</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.172266</td><td class="ca">0.012266</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33558" target="_blank" class="btn">HMDB33558</a></td><td class="ca">C13H24O11</td><td class="ca">356.13186161</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.147627</td><td class="ca">0.012373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35321" target="_blank" class="btn">HMDB35321</a></td><td class="ca">C13H24O11</td><td class="ca">356.13186161</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.147627</td><td class="ca">0.012373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41487" target="_blank" class="btn">HMDB41487</a></td><td class="ca">C13H24O11</td><td class="ca">356.13186161</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.147627</td><td class="ca">0.012373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39475" target="_blank" class="btn">HMDB39475</a></td><td class="ca">C13H24O11</td><td class="ca">356.13186161</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.147627</td><td class="ca">0.012373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29326" target="_blank" class="btn">HMDB29326</a></td><td class="ca">C19H19NO5</td><td class="ca">341.126322723</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.147543</td><td class="ca">0.012457</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33366" target="_blank" class="btn">HMDB33366</a></td><td class="ca">C19H19NO5</td><td class="ca">341.126322723</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.147543</td><td class="ca">0.012457</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14668" target="_blank" class="btn">HMDB14668</a></td><td class="ca">C20H29N3O2</td><td class="ca">343.225977187</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.145017</td><td class="ca">0.014983</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41441" target="_blank" class="btn">HMDB41441</a></td><td class="ca">C22H18O6</td><td class="ca">378.110338308</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.144161</td><td class="ca">0.015839</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31182" target="_blank" class="btn">HMDB31182</a></td><td class="ca">C16H19NO7</td><td class="ca">337.116151967</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.176522</td><td class="ca">0.016522</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61008" target="_blank" class="btn">HMDB61008</a></td><td class="ca">C10H13ClN2</td><td class="ca">196.076726133</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.176572</td><td class="ca">0.016572</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB42015" target="_blank" class="btn">HMDB42015</a></td><td class="ca">C21H26N2O2S2</td><td class="ca">402.143569466</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.177392</td><td class="ca">0.017392</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01857" target="_blank" class="btn">HMDB01857</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01982" target="_blank" class="btn">HMDB01982</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02026" target="_blank" class="btn">HMDB02026</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04308" target="_blank" class="btn">HMDB04308</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11103" target="_blank" class="btn">HMDB11103</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59704" target="_blank" class="btn">HMDB59704</a></td><td class="ca">C7H8N4O3</td><td class="ca">196.059640142</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.1424</td><td class="ca">0.0176</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30328" target="_blank" class="btn">HMDB30328</a></td><td class="ca">C19H27NO7</td><td class="ca">381.178752223</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.14191</td><td class="ca">0.01809</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41401" target="_blank" class="btn">HMDB41401</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30333" target="_blank" class="btn">HMDB30333</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33879" target="_blank" class="btn">HMDB33879</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33880" target="_blank" class="btn">HMDB33880</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30798" target="_blank" class="btn">HMDB30798</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35403" target="_blank" class="btn">HMDB35403</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30666" target="_blank" class="btn">HMDB30666</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35440" target="_blank" class="btn">HMDB35440</a></td><td class="ca">C21H24O5</td><td class="ca">356.162373878</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.178139</td><td class="ca">0.018139</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30435" target="_blank" class="btn">HMDB30435</a></td><td class="ca">C22H23NO6</td><td class="ca">397.152537473</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">420.141755</td><td class="ca">0.018245</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02040" target="_blank" class="btn">HMDB02040</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41290" target="_blank" class="btn">HMDB41290</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38774" target="_blank" class="btn">HMDB38774</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38965" target="_blank" class="btn">HMDB38965</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29459" target="_blank" class="btn">HMDB29459</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31055" target="_blank" class="btn">HMDB31055</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38712" target="_blank" class="btn">HMDB38712</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35525" target="_blank" class="btn">HMDB35525</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39471" target="_blank" class="btn">HMDB39471</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34213" target="_blank" class="btn">HMDB34213</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41123" target="_blank" class="btn">HMDB41123</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30682" target="_blank" class="btn">HMDB30682</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33027" target="_blank" class="btn">HMDB33027</a></td><td class="ca">C20H20O6</td><td class="ca">356.125988372</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30903" target="_blank" class="btn">HMDB30903</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33248" target="_blank" class="btn">HMDB33248</a></td><td class="ca">C10H10O3</td><td class="ca">178.062994186</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.141753</td><td class="ca">0.018247</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03409" target="_blank" class="btn">HMDB03409</a></td><td class="ca">C20H18NO4</td><td class="ca">336.123583069</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.178693</td><td class="ca">0.018693</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61059" target="_blank" class="btn">HMDB61059</a></td><td class="ca">C19H22ClN5O2</td><td class="ca">387.14620268</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.179692</td><td class="ca">0.019692</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61060" target="_blank" class="btn">HMDB61060</a></td><td class="ca">C19H22ClN5O2</td><td class="ca">387.14620268</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.179692</td><td class="ca">0.019692</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB11658" target="_blank" class="btn">HMDB11658</a></td><td class="ca">C15H15NO8</td><td class="ca">337.079766461</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.140136</td><td class="ca">0.019864</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13189" target="_blank" class="btn">HMDB13189</a></td><td class="ca">C15H15NO8</td><td class="ca">337.079766461</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.140136</td><td class="ca">0.019864</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00565" target="_blank" class="btn">HMDB00565</a></td><td class="ca">C6H12O7</td><td class="ca">196.058302738</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.139725</td><td class="ca">0.020275</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00625" target="_blank" class="btn">HMDB00625</a></td><td class="ca">C6H12O7</td><td class="ca">196.058302738</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.139725</td><td class="ca">0.020275</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03290" target="_blank" class="btn">HMDB03290</a></td><td class="ca">C6H12O7</td><td class="ca">196.058302738</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.139725</td><td class="ca">0.020275</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29287" target="_blank" class="btn">HMDB29287</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29288" target="_blank" class="btn">HMDB29288</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33999" target="_blank" class="btn">HMDB33999</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30654" target="_blank" class="btn">HMDB30654</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33997" target="_blank" class="btn">HMDB33997</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33563" target="_blank" class="btn">HMDB33563</a></td><td class="ca">C16H16O8</td><td class="ca">336.084517488</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.139627</td><td class="ca">0.020373</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34396" target="_blank" class="btn">HMDB34396</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40543" target="_blank" class="btn">HMDB40543</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39951" target="_blank" class="btn">HMDB39951</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41470" target="_blank" class="btn">HMDB41470</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38253" target="_blank" class="btn">HMDB38253</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38470" target="_blank" class="btn">HMDB38470</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37427" target="_blank" class="btn">HMDB37427</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35004" target="_blank" class="btn">HMDB35004</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37959" target="_blank" class="btn">HMDB37959</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38768" target="_blank" class="btn">HMDB38768</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37566" target="_blank" class="btn">HMDB37566</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40294" target="_blank" class="btn">HMDB40294</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37353" target="_blank" class="btn">HMDB37353</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37411" target="_blank" class="btn">HMDB37411</a></td><td class="ca">C33H40O20</td><td class="ca">756.21129372</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.13947</td><td class="ca">0.02053</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40350" target="_blank" class="btn">HMDB40350</a></td><td class="ca">C23H22O5</td><td class="ca">378.146723814</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.180547</td><td class="ca">0.020547</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30656" target="_blank" class="btn">HMDB30656</a></td><td class="ca">C23H22O5</td><td class="ca">378.146723814</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.180547</td><td class="ca">0.020547</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61313" target="_blank" class="btn">HMDB61313</a></td><td class="ca">C21H20ClFNO</td><td class="ca">356.121745179</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.13751</td><td class="ca">0.02249</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60562" target="_blank" class="btn">HMDB60562</a></td><td class="ca">C12H20N2O5S2</td><td class="ca">336.08136314</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.136473</td><td class="ca">0.023527</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29419" target="_blank" class="btn">HMDB29419</a></td><td class="ca">C6H11N3O4</td><td class="ca">189.074955855</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.183735</td><td class="ca">0.023735</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28731" target="_blank" class="btn">HMDB28731</a></td><td class="ca">C6H11N3O4</td><td class="ca">189.074955855</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.183735</td><td class="ca">0.023735</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB28836" target="_blank" class="btn">HMDB28836</a></td><td class="ca">C6H11N3O4</td><td class="ca">189.074955855</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.183735</td><td class="ca">0.023735</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31791" target="_blank" class="btn">HMDB31791</a></td><td class="ca">C25H22ClNO3</td><td class="ca">419.128821282</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">420.136097</td><td class="ca">0.023903</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14842" target="_blank" class="btn">HMDB14842</a></td><td class="ca">C20H23NO4</td><td class="ca">341.162708229</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.183928</td><td class="ca">0.023928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30184" target="_blank" class="btn">HMDB30184</a></td><td class="ca">C20H23NO4</td><td class="ca">341.162708229</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.183928</td><td class="ca">0.023928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31998" target="_blank" class="btn">HMDB31998</a></td><td class="ca">C20H23NO4</td><td class="ca">341.162708229</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.183928</td><td class="ca">0.023928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33789" target="_blank" class="btn">HMDB33789</a></td><td class="ca">C7H14O5</td><td class="ca">178.084123558</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.184012</td><td class="ca">0.024012</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15264" target="_blank" class="btn">HMDB15264</a></td><td class="ca">C19H20N2O3S</td><td class="ca">356.119463206</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.135228</td><td class="ca">0.024772</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14828" target="_blank" class="btn">HMDB14828</a></td><td class="ca">C21H23ClFN3O</td><td class="ca">387.151368285</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">420.184857</td><td class="ca">0.024857</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29569" target="_blank" class="btn">HMDB29569</a></td><td class="ca">C8H18S2</td><td class="ca">178.084991956</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.185749</td><td class="ca">0.025749</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40348" target="_blank" class="btn">HMDB40348</a></td><td class="ca">C8H18S2</td><td class="ca">178.084991956</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.185749</td><td class="ca">0.025749</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15540" target="_blank" class="btn">HMDB15540</a></td><td class="ca">C21H27N3O7S</td><td class="ca">465.156970923</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">420.185811</td><td class="ca">0.025811</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30340" target="_blank" class="btn">HMDB30340</a></td><td class="ca">C21H29NO3</td><td class="ca">343.214743799</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.133784</td><td class="ca">0.026216</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33959" target="_blank" class="btn">HMDB33959</a></td><td class="ca">C21H29NO3</td><td class="ca">343.214743799</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.133784</td><td class="ca">0.026216</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41190" target="_blank" class="btn">HMDB41190</a></td><td class="ca">C18H26O10</td><td class="ca">402.152597052</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.18642</td><td class="ca">0.02642</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41514" target="_blank" class="btn">HMDB41514</a></td><td class="ca">C18H26O10</td><td class="ca">402.152597052</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.18642</td><td class="ca">0.02642</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01260" target="_blank" class="btn">HMDB01260</a></td><td class="ca">C21H35N9O15P2</td><td class="ca">715.172784519</td><td class="ca">M+3ACN+2H</td><td class="ca">+</td><td class="ca">420.133489</td><td class="ca">0.026511</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB10336" target="_blank" class="btn">HMDB10336</a></td><td class="ca">C15H21NO9</td><td class="ca">359.121631275</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.186971</td><td class="ca">0.026971</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29452" target="_blank" class="btn">HMDB29452</a></td><td class="ca">C15H21NO9</td><td class="ca">359.121631275</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.186971</td><td class="ca">0.026971</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33107" target="_blank" class="btn">HMDB33107</a></td><td class="ca">C16H20N2O6</td><td class="ca">336.132136382</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.187246</td><td class="ca">0.027246</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37997" target="_blank" class="btn">HMDB37997</a></td><td class="ca">C21H21O12</td><td class="ca">465.103301136</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">420.132141</td><td class="ca">0.027859</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15576" target="_blank" class="btn">HMDB15576</a></td><td class="ca">C6H12N3PS</td><td class="ca">189.048954601</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.131732</td><td class="ca">0.028268</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61129" target="_blank" class="btn">HMDB61129</a></td><td class="ca">C17H17ClO5</td><td class="ca">336.076451361</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.131561</td><td class="ca">0.028439</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31826" target="_blank" class="btn">HMDB31826</a></td><td class="ca">C39H62NO16</td><td class="ca">800.406859941</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">420.188647</td><td class="ca">0.028647</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15178" target="_blank" class="btn">HMDB15178</a></td><td class="ca">C19H22FN3O4</td><td class="ca">375.159434412</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">420.130594</td><td class="ca">0.029406</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04645" target="_blank" class="btn">HMDB04645</a></td><td class="ca">C10H16N4O7S</td><td class="ca">336.073969576</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.12908</td><td class="ca">0.03092</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41257" target="_blank" class="btn">HMDB41257</a></td><td class="ca">C20H18O9</td><td class="ca">402.095082174</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.128905</td><td class="ca">0.031095</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39332" target="_blank" class="btn">HMDB39332</a></td><td class="ca">C36H36O18</td><td class="ca">756.190164348</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.128905</td><td class="ca">0.031095</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37437" target="_blank" class="btn">HMDB37437</a></td><td class="ca">C36H36O18</td><td class="ca">756.190164348</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.128905</td><td class="ca">0.031095</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32910" target="_blank" class="btn">HMDB32910</a></td><td class="ca">C36H36O18</td><td class="ca">756.190164348</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.128905</td><td class="ca">0.031095</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39609" target="_blank" class="btn">HMDB39609</a></td><td class="ca">C21H20O4</td><td class="ca">336.136159128</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.191269</td><td class="ca">0.031269</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35501" target="_blank" class="btn">HMDB35501</a></td><td class="ca">C21H20O4</td><td class="ca">336.136159128</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.191269</td><td class="ca">0.031269</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02250" target="_blank" class="btn">HMDB02250</a></td><td class="ca">C19H37NO4</td><td class="ca">343.272258677</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.191299</td><td class="ca">0.031299</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29332" target="_blank" class="btn">HMDB29332</a></td><td class="ca">C20H19NO4</td><td class="ca">337.131408101</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.191778</td><td class="ca">0.031778</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33524" target="_blank" class="btn">HMDB33524</a></td><td class="ca">C20H19NO4</td><td class="ca">337.131408101</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.191778</td><td class="ca">0.031778</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29827" target="_blank" class="btn">HMDB29827</a></td><td class="ca">C20H19NO4</td><td class="ca">337.131408101</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.191778</td><td class="ca">0.031778</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14970" target="_blank" class="btn">HMDB14970</a></td><td class="ca">C11H11NO2</td><td class="ca">189.078978601</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.19178</td><td class="ca">0.03178</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02302" target="_blank" class="btn">HMDB02302</a></td><td class="ca">C11H11NO2</td><td class="ca">189.078978601</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.19178</td><td class="ca">0.03178</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29738" target="_blank" class="btn">HMDB29738</a></td><td class="ca">C11H11NO2</td><td class="ca">189.078978601</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.19178</td><td class="ca">0.03178</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12201" target="_blank" class="btn">HMDB12201</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.127991</td><td class="ca">0.032009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12202" target="_blank" class="btn">HMDB12202</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.127991</td><td class="ca">0.032009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12203" target="_blank" class="btn">HMDB12203</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.127991</td><td class="ca">0.032009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41369" target="_blank" class="btn">HMDB41369</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.127991</td><td class="ca">0.032009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32000" target="_blank" class="btn">HMDB32000</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.127991</td><td class="ca">0.032009</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37688" target="_blank" class="btn">HMDB37688</a></td><td class="ca">C9H12N2O3</td><td class="ca">196.08479226</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.192705</td><td class="ca">0.032705</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32852" target="_blank" class="btn">HMDB32852</a></td><td class="ca">C9H12N2O3</td><td class="ca">196.08479226</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.192705</td><td class="ca">0.032705</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33965" target="_blank" class="btn">HMDB33965</a></td><td class="ca">C15H27NO10</td><td class="ca">381.163496089</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.126654</td><td class="ca">0.033346</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40866" target="_blank" class="btn">HMDB40866</a></td><td class="ca">C16H20O9</td><td class="ca">356.110732238</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.126497</td><td class="ca">0.033503</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36938" target="_blank" class="btn">HMDB36938</a></td><td class="ca">C16H20O9</td><td class="ca">356.110732238</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.126497</td><td class="ca">0.033503</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40664" target="_blank" class="btn">HMDB40664</a></td><td class="ca">C16H20O9</td><td class="ca">356.110732238</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.126497</td><td class="ca">0.033503</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31025" target="_blank" class="btn">HMDB31025</a></td><td class="ca">C41H62O15</td><td class="ca">794.408871314</td><td class="ca">M+2Na</td><td class="ca">+</td><td class="ca">420.193654</td><td class="ca">0.033654</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01162" target="_blank" class="btn">HMDB01162</a></td><td class="ca">C49H58FeN4O5</td><td class="ca">838.375663119</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">420.195108</td><td class="ca">0.035108</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32382" target="_blank" class="btn">HMDB32382</a></td><td class="ca">C19H23N3O3</td><td class="ca">341.173941617</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">420.195162</td><td class="ca">0.035162</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB05026" target="_blank" class="btn">HMDB05026</a></td><td class="ca">C18H21N3O3S</td><td class="ca">359.130362243</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.195702</td><td class="ca">0.035702</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30394" target="_blank" class="btn">HMDB30394</a></td><td class="ca">C16H25NO9</td><td class="ca">375.152931403</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">420.124091</td><td class="ca">0.035909</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15107" target="_blank" class="btn">HMDB15107</a></td><td class="ca">C22H24ClN3O</td><td class="ca">381.160790112</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">420.123948</td><td class="ca">0.036052</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14717" target="_blank" class="btn">HMDB14717</a></td><td class="ca">C17H18N2O6S</td><td class="ca">378.088557008</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.12238</td><td class="ca">0.03762</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38228" target="_blank" class="btn">HMDB38228</a></td><td class="ca">C13H23NO9</td><td class="ca">337.137281339</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.197651</td><td class="ca">0.037651</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12286" target="_blank" class="btn">HMDB12286</a></td><td class="ca">C8H15NO2S</td><td class="ca">189.082349419</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.198522</td><td class="ca">0.038522</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61100" target="_blank" class="btn">HMDB61100</a></td><td class="ca">C14H19N5O5</td><td class="ca">337.138618743</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.198989</td><td class="ca">0.038989</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01117" target="_blank" class="btn">HMDB01117</a></td><td class="ca">C12H23N2O9PS</td><td class="ca">402.086187546</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.120011</td><td class="ca">0.039989</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41986" target="_blank" class="btn">HMDB41986</a></td><td class="ca">C19H24N4O3</td><td class="ca">356.184840654</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.200606</td><td class="ca">0.040606</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61220" target="_blank" class="btn">HMDB61220</a></td><td class="ca">C19H24N4O3</td><td class="ca">356.184840654</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.200606</td><td class="ca">0.040606</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61221" target="_blank" class="btn">HMDB61221</a></td><td class="ca">C19H24N4O3</td><td class="ca">356.184840654</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.200606</td><td class="ca">0.040606</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59631" target="_blank" class="btn">HMDB59631</a></td><td class="ca">C14H12O</td><td class="ca">196.088815006</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.20075</td><td class="ca">0.04075</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00715" target="_blank" class="btn">HMDB00715</a></td><td class="ca">C10H7NO3</td><td class="ca">189.042593095</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.119009</td><td class="ca">0.040991</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60331" target="_blank" class="btn">HMDB60331</a></td><td class="ca">C10H7NO3</td><td class="ca">189.042593095</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.119009</td><td class="ca">0.040991</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60332" target="_blank" class="btn">HMDB60332</a></td><td class="ca">C10H7NO3</td><td class="ca">189.042593095</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">420.119009</td><td class="ca">0.040991</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14411" target="_blank" class="btn">HMDB14411</a></td><td class="ca">C19H12O6</td><td class="ca">336.063388116</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.118498</td><td class="ca">0.041502</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34129" target="_blank" class="btn">HMDB34129</a></td><td class="ca">C19H12O6</td><td class="ca">336.063388116</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.118498</td><td class="ca">0.041502</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34039" target="_blank" class="btn">HMDB34039</a></td><td class="ca">C19H12O6</td><td class="ca">336.063388116</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.118498</td><td class="ca">0.041502</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34049" target="_blank" class="btn">HMDB34049</a></td><td class="ca">C19H12O6</td><td class="ca">336.063388116</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.118498</td><td class="ca">0.041502</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37373" target="_blank" class="btn">HMDB37373</a></td><td class="ca">C39H32O16</td><td class="ca">756.169034976</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">420.11834</td><td class="ca">0.04166</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41231" target="_blank" class="btn">HMDB41231</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36900" target="_blank" class="btn">HMDB36900</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41349" target="_blank" class="btn">HMDB41349</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35053" target="_blank" class="btn">HMDB35053</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41002" target="_blank" class="btn">HMDB41002</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34474" target="_blank" class="btn">HMDB34474</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30657" target="_blank" class="btn">HMDB30657</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29542" target="_blank" class="btn">HMDB29542</a></td><td class="ca">C22H26O7</td><td class="ca">402.167853186</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36694" target="_blank" class="btn">HMDB36694</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36945" target="_blank" class="btn">HMDB36945</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34016" target="_blank" class="btn">HMDB34016</a></td><td class="ca">C22H26O7</td><td class="ca">402.167853186</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36897" target="_blank" class="btn">HMDB36897</a></td><td class="ca">C20H26O7</td><td class="ca">378.167853186</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.201676</td><td class="ca">0.041676</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60871" target="_blank" class="btn">HMDB60871</a></td><td class="ca">C44H55NO14</td><td class="ca">821.362255473</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">420.201678</td><td class="ca">0.041678</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60870" target="_blank" class="btn">HMDB60870</a></td><td class="ca">C44H55NO14</td><td class="ca">821.362255473</td><td class="ca">M+H+NH4</td><td class="ca">+</td><td class="ca">420.201678</td><td class="ca">0.041678</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33356" target="_blank" class="btn">HMDB33356</a></td><td class="ca">C21H26NO4</td><td class="ca">356.186183325</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.201948</td><td class="ca">0.041948</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41519" target="_blank" class="btn">HMDB41519</a></td><td class="ca">C20H20N2O3</td><td class="ca">336.147392516</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">420.202503</td><td class="ca">0.042503</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01132" target="_blank" class="btn">HMDB01132</a></td><td class="ca">C11H16NO9P</td><td class="ca">337.056267627</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.116638</td><td class="ca">0.043362</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14739" target="_blank" class="btn">HMDB14739</a></td><td class="ca">C16H20FN3O4</td><td class="ca">337.143784348</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.204154</td><td class="ca">0.044154</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB59612" target="_blank" class="btn">HMDB59612</a></td><td class="ca">C11H17N5O8P</td><td class="ca">378.081474057</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">420.115297</td><td class="ca">0.044703</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31833" target="_blank" class="btn">HMDB31833</a></td><td class="ca">C17H14ClN3O2S</td><td class="ca">359.049525104</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">420.114865</td><td class="ca">0.045135</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13929" target="_blank" class="btn">HMDB13929</a></td><td class="ca">C16H16ClNO3S</td><td class="ca">337.05394178</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.114312</td><td class="ca">0.045688</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29684" target="_blank" class="btn">HMDB29684</a></td><td class="ca">C7H6N4O2</td><td class="ca">178.049075456</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.113916</td><td class="ca">0.046084</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39318" target="_blank" class="btn">HMDB39318</a></td><td class="ca">C42H62O17</td><td class="ca">838.398700558</td><td class="ca">M+2H</td><td class="ca">+</td><td class="ca">420.206626</td><td class="ca">0.046626</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31714" target="_blank" class="btn">HMDB31714</a></td><td class="ca">C7H14OS2</td><td class="ca">178.04860645</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.112978</td><td class="ca">0.047022</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60667" target="_blank" class="btn">HMDB60667</a></td><td class="ca">C24H25NO</td><td class="ca">343.193614427</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.112654</td><td class="ca">0.047346</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61086" target="_blank" class="btn">HMDB61086</a></td><td class="ca">C24H25NO</td><td class="ca">343.193614427</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">420.112654</td><td class="ca">0.047346</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40241" target="_blank" class="btn">HMDB40241</a></td><td class="ca">C11H16OS</td><td class="ca">196.092185824</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">420.207492</td><td class="ca">0.047492</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41088" target="_blank" class="btn">HMDB41088</a></td><td class="ca">C26H27NO7</td><td class="ca">465.178752223</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">420.207592</td><td class="ca">0.047592</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01956" target="_blank" class="btn">HMDB01956</a></td><td class="ca">C40H40N4O14</td><td class="ca">800.254102008</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">420.112268</td><td class="ca">0.047732</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60775" target="_blank" class="btn">HMDB60775</a></td><td class="ca">C16H13ClFNO4</td><td class="ca">337.051713821</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">420.112084</td><td class="ca">0.047916</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61718" target="_blank" class="btn">HMDB61718</a></td><td class="ca">C21H28N2OS</td><td class="ca">356.192234218</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.207999</td><td class="ca">0.047999</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14645" target="_blank" class="btn">HMDB14645</a></td><td class="ca">C21H23ClFNO2</td><td class="ca">375.140134897</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">420.111295</td><td class="ca">0.048705</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00150" target="_blank" class="btn">HMDB00150</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01353" target="_blank" class="btn">HMDB01353</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01385" target="_blank" class="btn">HMDB01385</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02541" target="_blank" class="btn">HMDB02541</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB03466" target="_blank" class="btn">HMDB03466</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39724" target="_blank" class="btn">HMDB39724</a></td><td class="ca">C12H20O12</td><td class="ca">356.095476104</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39726" target="_blank" class="btn">HMDB39726</a></td><td class="ca">C12H20O12</td><td class="ca">356.095476104</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29938" target="_blank" class="btn">HMDB29938</a></td><td class="ca">C12H20O12</td><td class="ca">356.095476104</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39722" target="_blank" class="btn">HMDB39722</a></td><td class="ca">C12H20O12</td><td class="ca">356.095476104</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29932" target="_blank" class="btn">HMDB29932</a></td><td class="ca">C6H10O6</td><td class="ca">178.047738052</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">420.111241</td><td class="ca">0.048759</td></tr><tr class="green"><td class="ca" >mz_00004</td><td id="4" class="ca" >780.32</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB31947" target="_blank" class="btn">HMDB31947</a></td><td class="ca">C17H23NO8</td><td class="ca">369.142366717</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.318556</td><td class="ca">0.001444</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35940" target="_blank" class="btn">HMDB35940</a></td><td class="ca">C44H44O9</td><td class="ca">716.298533006</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">780.314298</td><td class="ca">0.005702</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33906" target="_blank" class="btn">HMDB33906</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39032" target="_blank" class="btn">HMDB39032</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32731" target="_blank" class="btn">HMDB32731</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39575" target="_blank" class="btn">HMDB39575</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32105" target="_blank" class="btn">HMDB32105</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35108" target="_blank" class="btn">HMDB35108</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30081" target="_blank" class="btn">HMDB30081</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36780" target="_blank" class="btn">HMDB36780</a></td><td class="ca">C20H24O7</td><td class="ca">376.152203122</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.327526</td><td class="ca">0.007526</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15535" target="_blank" class="btn">HMDB15535</a></td><td class="ca">C16H26N2O5S</td><td class="ca">358.156242642</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.32825</td><td class="ca">0.00825</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33715" target="_blank" class="btn">HMDB33715</a></td><td class="ca">C68H112O37</td><td class="ca">1520.688244598</td><td class="ca">M+H+K</td><td class="ca">+</td><td class="ca">780.329339</td><td class="ca">0.009339</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14038" target="_blank" class="btn">HMDB14038</a></td><td class="ca">C21H20FNO4</td><td class="ca">369.137636338</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.309096</td><td class="ca">0.010904</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38999" target="_blank" class="btn">HMDB38999</a></td><td class="ca">C17H26O6S</td><td class="ca">358.145009254</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.305784</td><td class="ca">0.014216</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00244" target="_blank" class="btn">HMDB00244</a></td><td class="ca">C17H20N4O6</td><td class="ca">376.138284392</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.299689</td><td class="ca">0.020311</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35698" target="_blank" class="btn">HMDB35698</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35467" target="_blank" class="btn">HMDB35467</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38113" target="_blank" class="btn">HMDB38113</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41276" target="_blank" class="btn">HMDB41276</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30573" target="_blank" class="btn">HMDB30573</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30709" target="_blank" class="btn">HMDB30709</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35789" target="_blank" class="btn">HMDB35789</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36837" target="_blank" class="btn">HMDB36837</a></td><td class="ca">C20H22O6</td><td class="ca">358.141638436</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.299042</td><td class="ca">0.020958</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40600" target="_blank" class="btn">HMDB40600</a></td><td class="ca">C16H24O10</td><td class="ca">376.136946988</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.297014</td><td class="ca">0.022986</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33300" target="_blank" class="btn">HMDB33300</a></td><td class="ca">C16H24O10</td><td class="ca">376.136946988</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.297014</td><td class="ca">0.022986</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33301" target="_blank" class="btn">HMDB33301</a></td><td class="ca">C16H24O10</td><td class="ca">376.136946988</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.297014</td><td class="ca">0.022986</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06676" target="_blank" class="btn">HMDB06676</a></td><td class="ca">C54H89N3O41</td><td class="ca">1435.497149365</td><td class="ca">M+3ACN+2H</td><td class="ca">+</td><td class="ca">780.295672</td><td class="ca">0.024328</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01069" target="_blank" class="btn">HMDB01069</a></td><td class="ca">C16H18N6O4</td><td class="ca">358.138953094</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">780.293671</td><td class="ca">0.026329</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33084" target="_blank" class="btn">HMDB33084</a></td><td class="ca">C21H23NO5</td><td class="ca">369.157622851</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.349069</td><td class="ca">0.029069</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36765" target="_blank" class="btn">HMDB36765</a></td><td class="ca">C21H23NO5</td><td class="ca">369.157622851</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.349069</td><td class="ca">0.029069</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61331" target="_blank" class="btn">HMDB61331</a></td><td class="ca">C21H23NO5</td><td class="ca">369.157622851</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.349069</td><td class="ca">0.029069</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38971" target="_blank" class="btn">HMDB38971</a></td><td class="ca">C19H24N2O6</td><td class="ca">376.16343651</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.349993</td><td class="ca">0.029993</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB00768" target="_blank" class="btn">HMDB00768</a></td><td class="ca">C14H23NO11</td><td class="ca">381.127110583</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.288044</td><td class="ca">0.031956</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33932" target="_blank" class="btn">HMDB33932</a></td><td class="ca">C23H20O5</td><td class="ca">376.13107375</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.285268</td><td class="ca">0.034732</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38229" target="_blank" class="btn">HMDB38229</a></td><td class="ca">C37H40N4O11</td><td class="ca">716.269358142</td><td class="ca">M+ACN+Na</td><td class="ca">+</td><td class="ca">780.285123</td><td class="ca">0.034877</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15107" target="_blank" class="btn">HMDB15107</a></td><td class="ca">C22H24ClN3O</td><td class="ca">381.160790112</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.355403</td><td class="ca">0.035403</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29788" target="_blank" class="btn">HMDB29788</a></td><td class="ca">C24H24O4</td><td class="ca">376.167459256</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">780.358039</td><td class="ca">0.038039</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29299" target="_blank" class="btn">HMDB29299</a></td><td class="ca">C32H40O17</td><td class="ca">696.226549854</td><td class="ca">M+IsoProp+Na+H</td><td class="ca">+</td><td class="ca">780.28166</td><td class="ca">0.03834</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61254" target="_blank" class="btn">HMDB61254</a></td><td class="ca">C38H41N3O11S</td><td class="ca">747.246179859</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">780.279669</td><td class="ca">0.040331</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB61256" target="_blank" class="btn">HMDB61256</a></td><td class="ca">C38H41N3O11S</td><td class="ca">747.246179859</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">780.279669</td><td class="ca">0.040331</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33965" target="_blank" class="btn">HMDB33965</a></td><td class="ca">C15H27NO10</td><td class="ca">381.163496089</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.360815</td><td class="ca">0.040815</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12364" target="_blank" class="btn">HMDB12364</a></td><td class="ca">C36H66NO10P</td><td class="ca">703.442433849</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">780.361474</td><td class="ca">0.041474</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12344" target="_blank" class="btn">HMDB12344</a></td><td class="ca">C36H66NO10P</td><td class="ca">703.442433849</td><td class="ca">M+2K+H</td><td class="ca">+</td><td class="ca">780.361474</td><td class="ca">0.041474</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06606" target="_blank" class="btn">HMDB06606</a></td><td class="ca">C29H49NO23</td><td class="ca">779.269536879</td><td class="ca">M+H</td><td class="ca">+</td><td class="ca">780.276813</td><td class="ca">0.043187</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB13001" target="_blank" class="btn">HMDB13001</a></td><td class="ca">C54H92O46</td><td class="ca">1476.485975556</td><td class="ca">M+2ACN+2H</td><td class="ca">+</td><td class="ca">780.276811</td><td class="ca">0.043189</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12201" target="_blank" class="btn">HMDB12201</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.36349</td><td class="ca">0.04349</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41369" target="_blank" class="btn">HMDB41369</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.36349</td><td class="ca">0.04349</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12202" target="_blank" class="btn">HMDB12202</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.36349</td><td class="ca">0.04349</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12203" target="_blank" class="btn">HMDB12203</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.36349</td><td class="ca">0.04349</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32000" target="_blank" class="btn">HMDB32000</a></td><td class="ca">C16H23N5O6</td><td class="ca">381.164833493</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.36349</td><td class="ca">0.04349</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29401" target="_blank" class="btn">HMDB29401</a></td><td class="ca">C20H19NO6</td><td class="ca">369.121237345</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.276298</td><td class="ca">0.043702</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33522" target="_blank" class="btn">HMDB33522</a></td><td class="ca">C21H19NO6</td><td class="ca">381.121237345</td><td class="ca">2M+NH4</td><td class="ca">+</td><td class="ca">780.276298</td><td class="ca">0.043702</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29360" target="_blank" class="btn">HMDB29360</a></td><td class="ca">C20H19NO6</td><td class="ca">369.121237345</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">780.276298</td><td class="ca">0.043702</td></tr></tbody><tbody class="select" id="page-id-2"><tr class="white"><td class="ca" >mz_00005</td><td id="5" class="ca" >956.25</td><td class="ca" colspan="7"></td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35451" target="_blank" class="btn">HMDB35451</a></td><td class="ca">C43H49O23</td><td class="ca">933.266462874</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">956.255681</td><td class="ca">0.005681</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38095" target="_blank" class="btn">HMDB38095</a></td><td class="ca">C43H49O23</td><td class="ca">933.266462874</td><td class="ca">M+Na</td><td class="ca">+</td><td class="ca">956.255681</td><td class="ca">0.005681</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40803" target="_blank" class="btn">HMDB40803</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02219" target="_blank" class="btn">HMDB02219</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38821" target="_blank" class="btn">HMDB38821</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40511" target="_blank" class="btn">HMDB40511</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34149" target="_blank" class="btn">HMDB34149</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33990" target="_blank" class="btn">HMDB33990</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35931" target="_blank" class="btn">HMDB35931</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29617" target="_blank" class="btn">HMDB29617</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36630" target="_blank" class="btn">HMDB36630</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41455" target="_blank" class="btn">HMDB41455</a></td><td class="ca">C22H22O10</td><td class="ca">446.121296924</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">956.258359</td><td class="ca">0.008359</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60157" target="_blank" class="btn">HMDB60157</a></td><td class="ca">C30H52N7O18P3S</td><td class="ca">923.230238121</td><td class="ca">M+CH3OH+H</td><td class="ca">+</td><td class="ca">956.263727</td><td class="ca">0.013727</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33021" target="_blank" class="btn">HMDB33021</a></td><td class="ca">C43H49O22</td><td class="ca">917.271548252</td><td class="ca">M+K</td><td class="ca">+</td><td class="ca">956.234706</td><td class="ca">0.015294</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB41153" target="_blank" class="btn">HMDB41153</a></td><td class="ca">C40H41O22</td><td class="ca">873.208947996</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">956.269318</td><td class="ca">0.019318</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60375" target="_blank" class="btn">HMDB60375</a></td><td class="ca">C35H54N7O19P3S</td><td class="ca">1001.240802807</td><td class="ca">M+2Na+H</td><td class="ca">+</td><td class="ca">956.269643</td><td class="ca">0.019643</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35163" target="_blank" class="btn">HMDB35163</a></td><td class="ca">C40H42O26</td><td class="ca">938.196431516</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">956.230255</td><td class="ca">0.019745</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29794" target="_blank" class="btn">HMDB29794</a></td><td class="ca">C40H42O26</td><td class="ca">938.196431516</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">956.230255</td><td class="ca">0.019745</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB04047" target="_blank" class="btn">HMDB04047</a></td><td class="ca">C27H44N7O19P3S</td><td class="ca">895.162552487</td><td class="ca">M+IsoProp+H</td><td class="ca">+</td><td class="ca">956.227892</td><td class="ca">0.022108</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40378" target="_blank" class="btn">HMDB40378</a></td><td class="ca">C45H38O21</td><td class="ca">914.190558278</td><td class="ca">M+ACN+H</td><td class="ca">+</td><td class="ca">956.224381</td><td class="ca">0.025619</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14756" target="_blank" class="btn">HMDB14756</a></td><td class="ca">C21H21ClN2O8</td><td class="ca">464.098643365</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.220407</td><td class="ca">0.029593</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB12207" target="_blank" class="btn">HMDB12207</a></td><td class="ca">C28H42N7O17P3S</td><td class="ca">873.157073179</td><td class="ca">M+2ACN+H</td><td class="ca">+</td><td class="ca">956.217443</td><td class="ca">0.032557</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35883" target="_blank" class="btn">HMDB35883</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37932" target="_blank" class="btn">HMDB37932</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34725" target="_blank" class="btn">HMDB34725</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33132" target="_blank" class="btn">HMDB33132</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40478" target="_blank" class="btn">HMDB40478</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB34360" target="_blank" class="btn">HMDB34360</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37362" target="_blank" class="btn">HMDB37362</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30775" target="_blank" class="btn">HMDB30775</a></td><td class="ca">C21H20O12</td><td class="ca">464.095476104</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.214072</td><td class="ca">0.035928</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB30747" target="_blank" class="btn">HMDB30747</a></td><td class="ca">C22H24O11</td><td class="ca">464.13186161</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.286843</td><td class="ca">0.036843</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB37535" target="_blank" class="btn">HMDB37535</a></td><td class="ca">C22H24O11</td><td class="ca">464.13186161</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">956.286843</td><td class="ca">0.036843</td></tr><tr class="white"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB14927" target="_blank" class="btn">HMDB14927</a></td><td class="ca">C28H54GdN5O20</td><td class="ca">938.260314726</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">956.294138</td><td class="ca">0.044138</td></tr><tr class="green"><td class="ca" >mz_00006</td><td id="6" class="ca" >1100.45</td><td class="ca" colspan="7"></td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB60499" target="_blank" class="btn">HMDB60499</a></td><td class="ca">C28H30N4O6</td><td class="ca">518.216534712</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">1100.448834</td><td class="ca">0.001166</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB32198" target="_blank" class="btn">HMDB32198</a></td><td class="ca">C30H34Cl2N4O</td><td class="ca">536.210967144</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">1100.445054</td><td class="ca">0.004946</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06568" target="_blank" class="btn">HMDB06568</a></td><td class="ca">C20H35NO15</td><td class="ca">529.200669455</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">1100.435162</td><td class="ca">0.014838</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB02060" target="_blank" class="btn">HMDB02060</a></td><td class="ca">C20H35NO15</td><td class="ca">529.200669455</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">1100.435162</td><td class="ca">0.014838</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB06582" target="_blank" class="btn">HMDB06582</a></td><td class="ca">C20H35NO15</td><td class="ca">529.200669455</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">1100.435162</td><td class="ca">0.014838</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB10345" target="_blank" class="btn">HMDB10345</a></td><td class="ca">C27H36O11</td><td class="ca">536.225761994</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">1100.474644</td><td class="ca">0.024644</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB36888" target="_blank" class="btn">HMDB36888</a></td><td class="ca">C27H36O11</td><td class="ca">536.225761994</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">1100.474644</td><td class="ca">0.024644</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB39422" target="_blank" class="btn">HMDB39422</a></td><td class="ca">C48H64N11O18</td><td class="ca">1082.443079299</td><td class="ca">M+NH4</td><td class="ca">+</td><td class="ca">1100.476902</td><td class="ca">0.026902</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB35520" target="_blank" class="btn">HMDB35520</a></td><td class="ca">C24H38O12</td><td class="ca">518.23632668</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">1100.488418</td><td class="ca">0.038418</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB38923" target="_blank" class="btn">HMDB38923</a></td><td class="ca">C24H38O12</td><td class="ca">518.23632668</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">1100.488418</td><td class="ca">0.038418</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB29773" target="_blank" class="btn">HMDB29773</a></td><td class="ca">C24H38O12</td><td class="ca">518.23632668</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">1100.488418</td><td class="ca">0.038418</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15455" target="_blank" class="btn">HMDB15455</a></td><td class="ca">C53H67N9O10S</td><td class="ca">1021.473160099</td><td class="ca">M+DMSO+H</td><td class="ca">+</td><td class="ca">1100.49438</td><td class="ca">0.04438</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB40723" target="_blank" class="btn">HMDB40723</a></td><td class="ca">C30H30O8</td><td class="ca">518.194067936</td><td class="ca">2M+ACN+Na</td><td class="ca">+</td><td class="ca">1100.403901</td><td class="ca">0.046099</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB01980" target="_blank" class="btn">HMDB01980</a></td><td class="ca">C46H65N13O12S2</td><td class="ca">1055.431705989</td><td class="ca">M+2Na-H</td><td class="ca">+</td><td class="ca">1100.402866</td><td class="ca">0.047134</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33282" target="_blank" class="btn">HMDB33282</a></td><td class="ca">C26H32O12</td><td class="ca">536.189376488</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">1100.401873</td><td class="ca">0.048127</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB33281" target="_blank" class="btn">HMDB33281</a></td><td class="ca">C26H32O12</td><td class="ca">536.189376488</td><td class="ca">2M+3H2O+2H</td><td class="ca">+</td><td class="ca">1100.401873</td><td class="ca">0.048127</td></tr><tr class="green"><td class="ca" colspan="2"></td><td class="ca"><a href="http://www.hmdb.ca/metabolites/HMDB15595" target="_blank" class="btn">HMDB15595</a></td><td class="ca">C28H22F3N7O</td><td class="ca">529.183792976</td><td class="ca">2M+ACN+H</td><td class="ca">+</td><td class="ca">1100.401409</td><td class="ca">0.048591</td></tr></tbody></table></div><div class="container"><hr><footer><div class="row"> <div class="col-lg-12"><p>Copyright © INRA, N Paulhe, F Giacomoni 2014 </p> </div> </div> </footer></div><script language="javascript">$(function() {$('#choose').pagination({items: 2,itemsOnPage: 1,currentPage: 1,onInit: function () { test(1); },cssStyle: 'light-theme',onPageClick: function(pageNumber){test(pageNumber)}}).pagination('redraw');});</script></body></html> \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/test_data/out_test03.tsv Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,1116 @@ +ID MASS_SUBMIT HMDB_ID CPD_FORMULA CPD_MW DELTA +mz_00001 175.01 HMDB60293 H2O3S2 113.94453531 0.000125 +mz_00001 175.01 HMDB03745 C2H6O3S2 141.975835438 0.000676 +mz_00001 175.01 HMDB31436 H4O4Si 95.987885149 0.000895 +mz_00001 175.01 HMDB33657 C17H10O6 310.047738052 0.000914 +mz_00001 175.01 HMDB35230 C17H10O6 310.047738052 0.000914 +mz_00001 175.01 HMDB34155 CH4N2S 76.009518828 0.001744 +mz_00001 175.01 HMDB01570 C10H13N2O7P 304.046037292 0.002237 +mz_00001 175.01 HMDB01270 C3H8O10P2 265.9592695 0.003458 +mz_00001 175.01 HMDB01294 C3H8O10P2 265.9592695 0.003458 +mz_00001 175.01 HMDB60394 C9H12FN2O8P 326.031530087 0.004012 +mz_00001 175.01 HMDB60015 C6H6O4S 173.99867937 0.004045 +mz_00001 175.01 HMDB00021 C9H10INO3 306.970536611 0.004182 +mz_00001 175.01 HMDB15167 C5H4N4S 152.015666838 0.005115 +mz_00001 175.01 HMDB40364 C3H7MnO6P 224.936074104 0.005134 +mz_00001 175.01 HMDB62056 C6H7O4P 174.008195703 0.005472 +mz_00001 175.01 HMDB41485 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB00209 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB06853 C4H4O 68.02621475 0.005588 +mz_00001 175.01 HMDB03767 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB40733 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB38176 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33968 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB29635 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33128 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB33766 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB40638 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32568 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB29686 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32603 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB32400 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB31459 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB13785 C4H4O 68.02621475 0.005588 +mz_00001 175.01 HMDB02340 C8H8O2 136.0524295 0.005588 +mz_00001 175.01 HMDB14912 C8H8F3N3O4S2 330.990831754 0.005966 +mz_00001 175.01 HMDB60764 C16H11ClN4O 310.062138701 0.006286 +mz_00001 175.01 HMDB40238 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB31370 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB37493 C6H10OS 130.045235632 0.006396 +mz_00001 175.01 HMDB37787 C5H10N2 98.08439833 0.006562 +mz_00001 175.01 HMDB61807 C10H9Cl3O2 265.966812653 0.007229 +mz_00001 175.01 HMDB59985 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB59987 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB60020 C11H12O8S 304.02528805 0.008138 +mz_00001 175.01 HMDB14581 C5H4N4O 136.03851077 0.008331 +mz_00001 175.01 HMDB00157 C5H4N4O 136.03851077 0.008331 +mz_00001 175.01 HMDB40631 C15H12O7 304.058302738 0.008369 +mz_00001 175.01 HMDB31778 C14H9ClF2N2O2 310.032061659 0.008752 +mz_00001 175.01 HMDB31160 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB33053 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB33054 C5H12S2 136.038041764 0.0088 +mz_00001 175.01 HMDB29694 C8H8OS 152.029585568 0.008804 +mz_00001 175.01 HMDB29783 C14H14O8 310.068867424 0.009651 +mz_00001 175.01 HMDB00613 C4H8O5 136.037173366 0.009669 +mz_00001 175.01 HMDB00943 C4H8O5 136.037173366 0.009669 +mz_00001 175.01 HMDB00115 C2H4O3 76.016043994 0.011306 +mz_00001 175.01 HMDB31608 C2H4O3 76.016043994 0.011306 +mz_00001 175.01 HMDB41797 C8H6Cl2O3 219.969399472 0.011761 +mz_00001 175.01 HMDB15413 C12H14N4O4S 310.073575646 0.012005 +mz_00001 175.01 HMDB15621 C12H14N4O4S 310.073575646 0.012005 +mz_00001 175.01 HMDB31825 C8H8S 136.034670946 0.012171 +mz_00001 175.01 HMDB31781 C14H15O2PS2 310.025107616 0.012229 +mz_00001 175.01 HMDB00634 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB00620 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB61185 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB00749 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB02092 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB33809 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB13233 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB59743 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB60365 C5H6O4 130.02660868 0.012231 +mz_00001 175.01 HMDB60689 C4H11Cl2N2O2P 219.993519532 0.01236 +mz_00001 175.01 HMDB60691 C4H11Cl2N2O2P 219.993519532 0.01236 +mz_00001 175.01 HMDB00292 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB00786 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB01182 C5H4N4O2 152.033425392 0.012643 +mz_00001 175.01 HMDB00072 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB00958 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB01264 C6H6O6 174.016437924 0.013714 +mz_00001 175.01 HMDB61101 C11H10BrN5O 307.006872614 0.013986 +mz_00001 175.01 HMDB01520 C17H21N4O9P 456.104614802 0.01409 +mz_00001 175.01 HMDB37945 C23H20O10 456.10564686 0.014434 +mz_00001 175.01 HMDB39328 C23H20O10 456.10564686 0.014434 +mz_00001 175.01 HMDB40200 C7H10OS2 174.017306322 0.014582 +mz_00001 175.01 HMDB29614 C13H21O2PS2 304.072057808 0.015247 +mz_00001 175.01 HMDB32909 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB38322 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB41450 C19H12O4 304.073558872 0.015997 +mz_00001 175.01 HMDB15176 C13H18Cl2N2O2 304.074533244 0.016485 +mz_00001 175.01 HMDB03152 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB33947 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB37819 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB30001 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB59711 C7H8N2O 136.063662888 0.016821 +mz_00001 175.01 HMDB40357 C18H14O5 310.084123558 0.017279 +mz_00001 175.01 HMDB03315 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31563 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB30332 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31564 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB33714 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB33549 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31498 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31497 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31196 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB31496 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB35239 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB40264 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB40271 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62031 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62127 C6H10O 98.073164942 0.017795 +mz_00001 175.01 HMDB62136 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61783 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61892 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61893 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61895 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB61894 C7H14 98.109550448 0.01859 +mz_00001 175.01 HMDB15679 C13H8Cl2N2O4 325.986112168 0.018697 +mz_00001 175.01 HMDB61135 C16H17ClN2S 304.080096951 0.019266 +mz_00001 175.01 HMDB29199 C14H14O9 326.063782046 0.020138 +mz_00001 175.01 HMDB12152 C9H17O12P 348.04576252 0.020157 +mz_00001 175.01 HMDB00175 C10H13N4O8P 348.047099924 0.020826 +mz_00001 175.01 HMDB11681 C10H13N4O8P 348.047099924 0.020826 +mz_00001 175.01 HMDB14684 C4H3FN2O2 130.017855555 0.020984 +mz_00001 175.01 HMDB39638 C9H6N2S 174.025168892 0.022445 +mz_00001 175.01 HMDB60086 C18H24N4O8S 456.131484454 0.023046 +mz_00001 175.01 HMDB14649 C12H9N3O5S 307.026291103 0.023696 +mz_00001 175.01 HMDB00695 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB00408 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB00491 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB01864 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB06024 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB10717 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33302 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33286 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31216 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31218 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB33698 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB31214 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB59876 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB12882 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB61881 C6H10O3 130.062994186 0.024154 +mz_00001 175.01 HMDB59664 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB31188 C2H4OS 75.99828544 0.024211 +mz_00001 175.01 HMDB35716 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB33670 C4H8O2S2 151.99657088 0.024211 +mz_00001 175.01 HMDB01067 C11H16N2O8 304.090665498 0.024551 +mz_00001 175.01 HMDB02818 C4H2N2O4 142.001456562 0.024946 +mz_00001 175.01 HMDB38442 C4H7NS2 133.001990609 0.025814 +mz_00001 175.01 HMDB00703 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB01101 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00020 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00440 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB00669 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB02390 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB03791 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB04815 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB12308 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB30662 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB41507 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB36907 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32919 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB41283 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29657 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32606 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB34172 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB30745 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB32604 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29661 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29662 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32572 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32629 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB33003 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB41294 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB32594 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB31609 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29658 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB29659 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB33866 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29660 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB32399 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB38519 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29179 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29175 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29228 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB29231 C16H16O6 304.094688244 0.026562 +mz_00001 175.01 HMDB60390 C8H8O3 152.047344122 0.026562 +mz_00001 175.01 HMDB62005 C8H8O3 152.047344118 0.026562 +mz_00001 175.01 HMDB11659 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB33919 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB31201 C5H12O4 136.073558872 0.026717 +mz_00001 175.01 HMDB14805 C5H15N3O8P2 307.033437495 0.027269 +mz_00001 175.01 HMDB00973 HO4P 95.961245032 0.027535 +mz_00001 175.01 HMDB36343 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB33100 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB37570 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB30590 C18H14O6 326.07903818 0.027766 +mz_00001 175.01 HMDB35880 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB30293 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB39958 C15H18O7 310.10525293 0.027843 +mz_00001 175.01 HMDB01216 C6H8N4 136.074896276 0.028054 +mz_00001 175.01 HMDB01525 C3H4N2 68.037448138 0.028054 +mz_00001 175.01 HMDB30577 C10H6O3 174.031694058 0.02897 +mz_00001 175.01 HMDB30773 C10H6O3 174.031694058 0.02897 +mz_00001 175.01 HMDB59586 C8HF17O3S 499.937494073 0.029579 +mz_00001 175.01 HMDB32943 C12H21N2O3PS 304.10104975 0.029743 +mz_00001 175.01 HMDB33548 C5H6O2S 130.008850126 0.02999 +mz_00001 175.01 HMDB34073 C10H16N4O7 304.101898886 0.030167 +mz_00001 175.01 HMDB39723 C11H18O11 326.084911418 0.030703 +mz_00001 175.01 HMDB40737 C11H18O11 326.084911418 0.030703 +mz_00001 175.01 HMDB60455 C6H3ClO4 173.971986291 0.030738 +mz_00001 175.01 HMDB38263 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB37457 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB35462 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB38262 C23H22O14 522.100955412 0.030928 +mz_00001 175.01 HMDB12916 CH2NO2S 91.980624003 0.030994 +mz_00001 175.01 HMDB11688 C5H12O11P2 309.98548425 0.032041 +mz_00001 175.01 HMDB38665 C15H16N2O5 304.105921632 0.032179 +mz_00001 175.01 HMDB61312 C15H14ClNO2S 307.043377094 0.032239 +mz_00001 175.01 HMDB37731 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB37762 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB29719 C6H6O2S 142.008850126 0.032339 +mz_00001 175.01 HMDB60503 C5H4O2 96.021129372 0.032349 +mz_00001 175.01 HMDB32914 C5H4O2 96.021129372 0.032349 +mz_00001 175.01 HMDB62029 C5H4O2 96.021129369 0.032349 +mz_00001 175.01 HMDB01059 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB01187 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB03848 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB04527 C6H16O18P4 499.928709756 0.032507 +mz_00001 175.01 HMDB11741 C14H18N2O6 310.116486318 0.03346 +mz_00001 175.01 HMDB15140 CH4N2O2 76.027277382 0.033773 +mz_00001 175.01 HMDB34833 H8N2S 68.040818956 0.034796 +mz_00001 175.01 HMDB33956 C4H7Cl2O4P 219.945900638 0.035259 +mz_00001 175.01 HMDB29396 C5H10N2O2 130.074227574 0.035388 +mz_00001 175.01 HMDB30405 C5H10N2O2 130.074227574 0.035388 +mz_00001 175.01 HMDB36635 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB41298 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB33310 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB31744 C19H18O4 310.120509064 0.035472 +mz_00001 175.01 HMDB00839 C20H14N4 310.121846468 0.03614 +mz_00001 175.01 HMDB39926 C22H28O11S 500.135232428 0.036334 +mz_00001 175.01 HMDB01448 O4S 95.951729178 0.037051 +mz_00001 175.01 HMDB15102 C19H19ClN2 310.123676325 0.037055 +mz_00001 175.01 HMDB04230 C5H5NO2 111.032028409 0.037793 +mz_00001 175.01 HMDB38175 C5H5NO2 111.032028409 0.037793 +mz_00001 175.01 HMDB04194 C7H8N2O2 152.05857751 0.037796 +mz_00001 175.01 HMDB04193 C7H8N2O2 152.05857751 0.037796 +mz_00001 175.01 HMDB33581 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39509 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39167 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB39169 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36936 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36735 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB60077 C15H18O8 326.100167552 0.038331 +mz_00001 175.01 HMDB36981 C25H28O8 456.178417872 0.038691 +mz_00001 175.01 HMDB01202 C9H14N3O7P 307.056936329 0.039018 +mz_00001 175.01 HMDB60488 CH4Se 95.947821956 0.040958 +mz_00001 175.01 HMDB30879 C2H6SSe 141.93554271 0.040968 +mz_00001 175.01 HMDB03638 Cd 113.903358121 0.041302 +mz_00001 175.01 HMDB14694 C15H13N3O4S 331.062676609 0.041888 +mz_00001 175.01 HMDB34416 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB37290 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB31470 C4H8S3 151.978812326 0.04197 +mz_00001 175.01 HMDB31628 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB34378 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31627 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB33962 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31312 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38985 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32621 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38988 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32624 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38986 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB39782 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB29667 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32625 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32149 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32029 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38987 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB38984 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32544 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB31446 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB32441 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB59896 C9H12O 136.088815006 0.041973 +mz_00001 175.01 HMDB34894 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB38696 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB33909 C12H20N2O7 304.127051004 0.042744 +mz_00001 175.01 HMDB31537 C7H14S 130.081621138 0.042781 +mz_00001 175.01 HMDB02332 C3H4O5S 151.977943928 0.042838 +mz_00001 175.01 HMDB60768 C4H6N2O 98.048012824 0.042947 +mz_00001 175.01 HMDB37336 C24H26O13 522.137340918 0.043056 +mz_00001 175.01 HMDB33705 C24H26O13 522.137340918 0.043056 +mz_00001 175.01 HMDB62164 C4H7NO2S 133.019749643 0.043573 +mz_00001 175.01 HMDB12236 C6H9N2O5P 220.02490792 0.043748 +mz_00001 175.01 HMDB39123 C14H18N2O7 326.11140094 0.043947 +mz_00001 175.01 HMDB14843 C22H28N6O3S 456.194359482 0.044004 +mz_00001 175.01 HMDB39777 C28H24N2O7 500.158351132 0.04404 +mz_00001 175.01 HMDB00905 C10H14N5O6P 331.068169717 0.044635 +mz_00001 175.01 HMDB37494 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB35790 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB29305 C17H20O5 304.13107375 0.044755 +mz_00001 175.01 HMDB32956 C12H10O7 266.042652674 0.045149 +mz_00001 175.01 HMDB32746 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32747 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32744 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB32745 C4H8OS2 136.001656258 0.045186 +mz_00001 175.01 HMDB34015 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB30606 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB30605 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40315 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40313 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB41299 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB40930 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB34279 C19H18O5 326.115423686 0.045959 +mz_00001 175.01 HMDB00508 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB00568 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB01851 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB02917 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB33730 C5H12O5 152.068473494 0.047691 +mz_00001 175.01 HMDB39788 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB39787 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB31853 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB32939 C5H6S2 129.991091572 0.047748 +mz_00001 175.01 HMDB14118 C2HF3O2 113.992863891 0.048204 +mz_00001 175.01 HMDB31238 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB31634 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB34238 C3H8S 76.034670946 0.04856 +mz_00001 175.01 HMDB15583 C22H18N2 310.146998586 0.048716 +mz_00001 175.01 HMDB06590 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB06701 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB29523 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB40154 C12H22O10 326.121296924 0.048895 +mz_00001 175.01 HMDB00630 C4H5N3O 111.043261797 0.049027 +mz_00001 175.01 HMDB14021 C19H19FN2O 310.148141445 0.049288 +mz_00001 175.01 HMDB60576 C19H19FN2O 310.148141445 0.049288 +mz_00001 175.01 HMDB03826 C13H18N4O6 326.122634328 0.049564 +mz_00002 238.19 HMDB04043 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36086 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB04472 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB05812 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35861 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB38025 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37049 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB31410 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB41034 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35815 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35819 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36126 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36112 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37047 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36196 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35955 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36068 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34976 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35818 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36077 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37019 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34848 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35820 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35842 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35954 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37016 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35783 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35825 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37048 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36096 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37133 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36097 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36993 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36991 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37007 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35841 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB32118 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36100 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37006 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35823 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37161 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37215 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB41014 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35155 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36996 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB30999 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36101 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36102 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36107 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36041 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34972 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB40448 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB37214 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34969 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB36078 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB38185 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35838 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35162 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB34932 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35272 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB35833 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB32530 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59881 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59864 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB59869 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB61802 C10H18O 154.135765198 0.000875 +mz_00002 238.19 HMDB01422 C9H21N2O3 205.155217548 0.001293 +mz_00002 238.19 HMDB30326 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB31179 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB39833 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB39834 C9H17NO 155.131014171 0.001384 +mz_00002 238.19 HMDB14888 C13H20N2O 220.157563272 0.001386 +mz_00002 238.19 HMDB14362 C10H15N3 177.126597495 0.001937 +mz_00002 238.19 HMDB30898 C28H40O 392.307915902 0.002219 +mz_00002 238.19 HMDB40385 C39H41NO9 667.278131915 0.002234 +mz_00002 238.19 HMDB39692 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34644 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34683 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34505 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB35326 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB34528 C30H50O4 474.370910088 0.002731 +mz_00002 238.19 HMDB15415 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB28890 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB28953 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB41845 C12H21N5O3 283.164439563 0.00328 +mz_00002 238.19 HMDB12189 C8H21N3 159.173547687 0.004768 +mz_00002 238.19 HMDB31506 C8H21N3 159.173547687 0.004768 +mz_00002 238.19 HMDB34814 C30H54O 430.41746635 0.007951 +mz_00002 238.19 HMDB04437 C4H11NO2 105.078978601 0.008923 +mz_00002 238.19 HMDB34839 C31H48O2 452.36543078 0.009038 +mz_00002 238.19 HMDB60502 C31H48O2 452.36543078 0.009038 +mz_00002 238.19 HMDB35234 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB37327 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB35536 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB35537 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB37328 C29H56O2 436.428031036 0.009233 +mz_00002 238.19 HMDB14968 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40017 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB39667 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB33484 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB39664 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40018 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40020 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40027 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40014 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB40019 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB41923 C11H15NO 177.115364107 0.009296 +mz_00002 238.19 HMDB30273 C28H46N2O4 474.34575797 0.009845 +mz_00002 238.19 HMDB00698 C26H43NO4 433.319208869 0.009846 +mz_00002 238.19 HMDB15072 C13H19NO 205.146664235 0.009847 +mz_00002 238.19 HMDB00946 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB03315 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB00348 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00361 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00384 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00411 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00438 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00478 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00514 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00518 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00626 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00664 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00686 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00733 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB00811 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02451 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02488 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02536 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB02585 C24H40O4 392.292659768 0.009847 +mz_00002 238.19 HMDB32901 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31692 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31030 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB36599 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB34903 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB39539 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB38996 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB37606 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB31563 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB38280 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB41469 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB30332 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB32193 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40277 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB35157 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB36389 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40206 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB31564 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB29728 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40217 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40226 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB30867 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB38270 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB30945 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB33714 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB33549 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31498 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31497 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31196 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB39522 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40725 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB13817 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB29721 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB37718 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB31496 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB31541 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB36048 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40397 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB32051 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB35239 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB41494 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB40264 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB37714 C14H20O2 220.146329884 0.009847 +mz_00002 238.19 HMDB40278 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40227 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB37301 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB61891 C7H10O 110.073164942 0.009847 +mz_00002 238.19 HMDB40271 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB32331 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB62144 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB60843 C13H19NO 205.146664235 0.009847 +mz_00002 238.19 HMDB61816 C12H20O2 196.146329884 0.009847 +mz_00002 238.19 HMDB62031 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB62127 C6H10O 98.073164942 0.009847 +mz_00002 238.19 HMDB07895 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB08917 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB11203 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB11370 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB13402 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB13403 C38H76NO7P 689.535940303 0.010097 +mz_00002 238.19 HMDB01893 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB12171 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB30022 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB59642 C29H50O2 430.381080844 0.010242 +mz_00002 238.19 HMDB37163 C11H24O4 220.167459256 0.011282 +mz_00002 238.19 HMDB30083 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB37639 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB40267 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB61936 C10H22O2 174.161979948 0.012255 +mz_00002 238.19 HMDB37787 C5H10N2 98.08439833 0.01262 +mz_00002 238.19 HMDB01009 C11H17N2 177.139173554 0.014514 +mz_00002 238.19 HMDB35144 C29H46O5 474.334524582 0.015462 +mz_00002 238.19 HMDB35221 C29H46O5 474.334524582 0.015462 +mz_00002 238.19 HMDB00483 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00513 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00556 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB00558 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB02180 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB02208 C27H48O5 452.350174646 0.016666 +mz_00002 238.19 HMDB60994 C15H25NO4 283.178358293 0.017198 +mz_00002 238.19 HMDB39019 C27H36O2 392.271530396 0.020412 +mz_00002 238.19 HMDB08838 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08839 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08870 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08869 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08931 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08963 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB08962 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09122 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09155 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09187 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09317 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09350 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09382 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB09415 C39H70NO8P 711.483904733 0.021422 +mz_00002 238.19 HMDB07901 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB07933 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB08827 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08828 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08859 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB08924 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08956 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB08987 C37H72NO8P 689.499554797 0.022225 +mz_00002 238.19 HMDB09019 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB09052 C37H72NO8P 689.49955528 0.022225 +mz_00002 238.19 HMDB15050 C10H15N5 205.132745505 0.023765 +mz_00002 238.19 HMDB35360 C7H15NO4 177.100107973 0.024552 +mz_00002 238.19 HMDB29936 C9H20NO2 174.149403889 0.024831 +mz_00002 238.19 HMDB13223 C9H20NO2 174.149403889 0.024831 +mz_00002 238.19 HMDB04231 C9H19NO4 205.131408101 0.025103 +mz_00002 238.19 HMDB35645 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37395 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35720 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB39711 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36118 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35306 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34940 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB30232 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36793 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35097 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36789 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35020 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB41490 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB40763 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38209 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB33826 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38123 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38134 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB39532 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35718 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38193 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36717 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38208 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36788 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38160 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35704 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37069 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35026 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35793 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38212 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35739 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38146 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36420 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36798 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36402 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36192 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38119 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37275 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB38982 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB37392 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB60356 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34718 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB34661 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38211 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB41404 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB36716 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB38512 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB35391 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB36172 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB38210 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB32220 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB32247 C13H24O 196.18271539 0.026538 +mz_00002 238.19 HMDB37811 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB13688 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB59836 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB60295 C15H24O 220.18271539 0.026538 +mz_00002 238.19 HMDB00520 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB00524 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB00655 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB01231 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB01968 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB29851 C27H48O4 436.355260024 0.027153 +mz_00002 238.19 HMDB35888 C30H44O3 452.329045274 0.02723 +mz_00002 238.19 HMDB37065 C30H44O3 452.329045274 0.02723 +mz_00002 238.19 HMDB29993 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB30296 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB32868 C30H60O 436.464416542 0.027425 +mz_00002 238.19 HMDB60730 C23H36O5 392.256274262 0.02804 +mz_00002 238.19 HMDB12166 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB37914 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB38353 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB35513 C28H46O3 430.344695338 0.028434 +mz_00002 238.19 HMDB10701 C36H72NO6P 645.509725553 0.030873 +mz_00002 238.19 HMDB38163 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB32564 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB38162 C15H16 196.125200512 0.030976 +mz_00002 238.19 HMDB14647 C19H25NO 283.193614427 0.032454 +mz_00002 238.19 HMDB13972 C19H25NO 283.193614427 0.032454 +mz_00002 238.19 HMDB28799 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB29151 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB28883 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB28899 C11H17N5O4 283.128054057 0.033106 +mz_00002 238.19 HMDB15508 C15H21N 215.167399677 0.033382 +mz_00002 238.19 HMDB36683 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB59826 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB59696 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB61824 C13H18 174.140850576 0.033384 +mz_00002 238.19 HMDB30085 C28H42O6 474.298139076 0.033654 +mz_00002 238.19 HMDB60061 C16H34NO5P 351.217459715 0.034173 +mz_00002 238.19 HMDB41940 C9H11N3O 177.090211989 0.034448 +mz_00002 238.19 HMDB29741 C10H16N2O2 196.121177766 0.034999 +mz_00002 238.19 HMDB40551 C10H16N2O2 196.121177766 0.034999 +mz_00002 238.19 HMDB30353 C8H13NO2 155.094628665 0.035001 +mz_00002 238.19 HMDB62098 C8H13NO2 155.094628663 0.035001 +mz_00002 238.19 HMDB31659 C5H13N 87.104799421 0.035364 +mz_00002 238.19 HMDB32392 C5H13N 87.104799421 0.035364 +mz_00002 238.19 HMDB31202 C12H29N3 215.236147943 0.035366 +mz_00002 238.19 HMDB35135 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB38697 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB38268 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB31302 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB37276 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB36177 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB36239 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB40285 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB32314 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB32442 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB60285 C9H14O2 154.099379692 0.03551 +mz_00002 238.19 HMDB29888 C24H46O6 430.329439204 0.036062 +mz_00002 238.19 HMDB29551 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB31205 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB61812 C11H22 154.172150704 0.037261 +mz_00002 238.19 HMDB62070 C11H22 154.172150708 0.037261 +mz_00002 238.19 HMDB60817 C10H21N3O2 215.163376931 0.037405 +mz_00002 238.19 HMDB33870 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB01080 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB60247 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB31581 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB31215 C4H9NO 87.068413915 0.037407 +mz_00002 238.19 HMDB13287 C8H18N2O2 174.13682783 0.037407 +mz_00002 238.19 HMDB04649 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB35983 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB30395 C30H44O2 436.334130652 0.037718 +mz_00002 238.19 HMDB15659 C10H21N 155.167399677 0.03777 +mz_00002 238.19 HMDB32350 C10H21N 155.167399677 0.03777 +mz_00002 238.19 HMDB29987 C30H60O2 452.459331164 0.037913 +mz_00002 238.19 HMDB30925 C30H60O2 452.459331164 0.037913 +mz_00002 238.19 HMDB31977 C26H32O3 392.23514489 0.038605 +mz_00002 238.19 HMDB35640 C31H42O 430.323565966 0.038999 +mz_00002 238.19 HMDB07003 C19H37O6P 392.232775428 0.039789 +mz_00002 238.19 HMDB02372 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB03563 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB30191 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB39521 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB34669 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB32845 C17H17NO3 283.120843415 0.040317 +mz_00002 238.19 HMDB14592 C19H29NO5 351.204573043 0.040616 +mz_00002 238.19 HMDB35472 C44H89NO5 711.674074963 0.041968 +mz_00002 238.19 HMDB14375 C8H17NO2 159.125928793 0.042851 +mz_00002 238.19 HMDB00991 C8H17NO2 159.125928793 0.042851 +mz_00002 238.19 HMDB59796 C29H57N5O12 667.400372313 0.042981 +mz_00002 238.19 HMDB08883 C35H68NO7P 645.473340047 0.043002 +mz_00002 238.19 HMDB11336 C35H68NO7P 645.473340047 0.043002 +mz_00002 238.19 HMDB12501 C23H39NO6S 457.249808675 0.044546 +mz_00002 238.19 HMDB29802 C27H52O 392.401816286 0.044731 +mz_00002 238.19 HMDB14354 C25H30NO3 392.222568831 0.044893 +mz_00002 238.19 HMDB02195 C26H44O5 436.318874518 0.045346 +mz_00002 238.19 HMDB30092 C31H64 436.500802048 0.045618 +mz_00002 238.19 HMDB01855 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB33482 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB37693 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB40045 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB12490 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB60063 C10H11NO2 177.078978601 0.045681 +mz_00002 238.19 HMDB40046 C12H15NO2 205.110278729 0.046232 +mz_00002 238.19 HMDB32589 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB36226 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB37734 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB37492 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB40424 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB34662 C22H32O6 392.219888756 0.046233 +mz_00002 238.19 HMDB37725 C11H16O3 196.109944378 0.046233 +mz_00002 238.19 HMDB61823 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB61942 C13H16O3 220.109944378 0.046233 +mz_00002 238.19 HMDB11560 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB11590 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB12458 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB34403 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB36249 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB30066 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB60127 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB60128 C27H42O4 430.308309832 0.046627 +mz_00002 238.19 HMDB13279 C11H21NO3 215.152143543 0.048638 +mz_00002 238.19 HMDB34040 C9H18O3 174.125594442 0.048641 +mz_00002 238.19 HMDB31513 C9H18O3 174.125594442 0.048641 +mz_00002 238.19 HMDB41818 C16H14FN3O 283.11209029 0.04907 +mz_00002 238.19 HMDB12271 C5H11N3O4 177.074955855 0.049704 +mz_00003 420.16 HMDB60836 C17H17N3O4S 359.093976737 0.000683 +mz_00003 420.16 HMDB60838 C17H17N3O4S 359.093976737 0.000683 +mz_00003 420.16 HMDB33374 C16H19NO5S 337.098393413 0.001237 +mz_00003 420.16 HMDB00590 C7H11NO5 189.063722467 0.001268 +mz_00003 420.16 HMDB01138 C7H11NO5 189.063722467 0.001268 +mz_00003 420.16 HMDB14535 C15H23N3O4S 341.140926929 0.002147 +mz_00003 420.16 HMDB15135 C15H23N3O4S 341.140926929 0.002147 +mz_00003 420.16 HMDB30384 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB36989 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB30189 C19H18ClNO4 359.092435776 0.002224 +mz_00003 420.16 HMDB40341 C34H44O19 756.247679226 0.002337 +mz_00003 420.16 HMDB40372 C34H44O19 756.247679226 0.002337 +mz_00003 420.16 HMDB31695 C17H24O8 356.147117744 0.002883 +mz_00003 420.16 HMDB40558 C17H24O8 356.147117744 0.002883 +mz_00003 420.16 HMDB31574 C8H15NS2 189.064590865 0.003005 +mz_00003 420.16 HMDB32499 C8H15NS2 189.064590865 0.003005 +mz_00003 420.16 HMDB15253 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB01267 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB04145 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB04146 C9H10N2O2 178.074227574 0.00422 +mz_00003 420.16 HMDB41452 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29533 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB30141 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB34027 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB30450 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB37922 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29791 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB29787 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB34050 C20H16O5 336.099773622 0.005116 +mz_00003 420.16 HMDB04662 C11H19N3O7S 337.094370667 0.005259 +mz_00003 420.16 HMDB39733 C11H19N3O7S 337.094370667 0.005259 +mz_00003 420.16 HMDB31401 C20H21NO7 387.131802031 0.005291 +mz_00003 420.16 HMDB35415 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB39137 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB35037 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB29308 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB37755 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB39379 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB29540 C21H22O8 402.13146768 0.005291 +mz_00003 420.16 HMDB29304 C19H22O8 378.13146768 0.005291 +mz_00003 420.16 HMDB33211 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB39157 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB29286 C18H17NO7 359.100501903 0.005842 +mz_00003 420.16 HMDB06591 C12H23NO10 341.132195961 0.006584 +mz_00003 420.16 HMDB11668 C12H23NO10 341.132195961 0.006584 +mz_00003 420.16 HMDB33395 C39H50O20 838.28954404 0.007952 +mz_00003 420.16 HMDB32864 C16H23NO7 341.147452095 0.008672 +mz_00003 420.16 HMDB30934 C14H17NO10 359.085245769 0.009414 +mz_00003 420.16 HMDB14502 C17H16F6N2O 378.116682374 0.009495 +mz_00003 420.16 HMDB37265 C16H21NO10 387.116545897 0.009965 +mz_00003 420.16 HMDB37262 C16H21NO10 387.116545897 0.009965 +mz_00003 420.16 HMDB59971 C17H22O11 402.116211546 0.009965 +mz_00003 420.16 HMDB59973 C17H22O11 402.116211546 0.009965 +mz_00003 420.16 HMDB28896 C17H19N5O3 341.148789499 0.010009 +mz_00003 420.16 HMDB29085 C17H19N5O3 341.148789499 0.010009 +mz_00003 420.16 HMDB00434 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB40256 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB35721 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB30571 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB29648 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB37177 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB29645 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB39427 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB40637 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB32365 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB62121 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60398 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60733 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB60735 C10H12O4 196.073558872 0.010238 +mz_00003 420.16 HMDB11739 C12H26O13 378.137340918 0.011164 +mz_00003 420.16 HMDB33927 C12H20N2O9 336.116880248 0.01199 +mz_00003 420.16 HMDB33187 C14H10 178.07825032 0.012266 +mz_00003 420.16 HMDB33558 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB35321 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB41487 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB39475 C13H24O11 356.13186161 0.012373 +mz_00003 420.16 HMDB29326 C19H19NO5 341.126322723 0.012457 +mz_00003 420.16 HMDB33366 C19H19NO5 341.126322723 0.012457 +mz_00003 420.16 HMDB14668 C20H29N3O2 343.225977187 0.014983 +mz_00003 420.16 HMDB41441 C22H18O6 378.110338308 0.015839 +mz_00003 420.16 HMDB31182 C16H19NO7 337.116151967 0.016522 +mz_00003 420.16 HMDB61008 C10H13ClN2 196.076726133 0.016572 +mz_00003 420.16 HMDB42015 C21H26N2O2S2 402.143569466 0.017392 +mz_00003 420.16 HMDB01857 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB01982 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB02026 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB04308 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB11103 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB59704 C7H8N4O3 196.059640142 0.0176 +mz_00003 420.16 HMDB30328 C19H27NO7 381.178752223 0.01809 +mz_00003 420.16 HMDB41401 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30333 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB33879 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB33880 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30798 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB35403 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30666 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB35440 C21H24O5 356.162373878 0.018139 +mz_00003 420.16 HMDB30435 C22H23NO6 397.152537473 0.018245 +mz_00003 420.16 HMDB02040 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB41290 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB38774 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB38965 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB29459 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB31055 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB38712 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB35525 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB39471 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB34213 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB41123 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB30682 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB33027 C20H20O6 356.125988372 0.018247 +mz_00003 420.16 HMDB30903 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB33248 C10H10O3 178.062994186 0.018247 +mz_00003 420.16 HMDB03409 C20H18NO4 336.123583069 0.018693 +mz_00003 420.16 HMDB61059 C19H22ClN5O2 387.14620268 0.019692 +mz_00003 420.16 HMDB61060 C19H22ClN5O2 387.14620268 0.019692 +mz_00003 420.16 HMDB11658 C15H15NO8 337.079766461 0.019864 +mz_00003 420.16 HMDB13189 C15H15NO8 337.079766461 0.019864 +mz_00003 420.16 HMDB00565 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB00625 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB03290 C6H12O7 196.058302738 0.020275 +mz_00003 420.16 HMDB29287 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB29288 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33999 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB30654 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33997 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB33563 C16H16O8 336.084517488 0.020373 +mz_00003 420.16 HMDB34396 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40543 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB39951 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB41470 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38253 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38470 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37427 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB35004 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37959 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB38768 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37566 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40294 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37353 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB37411 C33H40O20 756.21129372 0.02053 +mz_00003 420.16 HMDB40350 C23H22O5 378.146723814 0.020547 +mz_00003 420.16 HMDB30656 C23H22O5 378.146723814 0.020547 +mz_00003 420.16 HMDB61313 C21H20ClFNO 356.121745179 0.02249 +mz_00003 420.16 HMDB60562 C12H20N2O5S2 336.08136314 0.023527 +mz_00003 420.16 HMDB29419 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB28731 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB28836 C6H11N3O4 189.074955855 0.023735 +mz_00003 420.16 HMDB31791 C25H22ClNO3 419.128821282 0.023903 +mz_00003 420.16 HMDB14842 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB30184 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB31998 C20H23NO4 341.162708229 0.023928 +mz_00003 420.16 HMDB33789 C7H14O5 178.084123558 0.024012 +mz_00003 420.16 HMDB15264 C19H20N2O3S 356.119463206 0.024772 +mz_00003 420.16 HMDB14828 C21H23ClFN3O 387.151368285 0.024857 +mz_00003 420.16 HMDB29569 C8H18S2 178.084991956 0.025749 +mz_00003 420.16 HMDB40348 C8H18S2 178.084991956 0.025749 +mz_00003 420.16 HMDB15540 C21H27N3O7S 465.156970923 0.025811 +mz_00003 420.16 HMDB30340 C21H29NO3 343.214743799 0.026216 +mz_00003 420.16 HMDB33959 C21H29NO3 343.214743799 0.026216 +mz_00003 420.16 HMDB41190 C18H26O10 402.152597052 0.02642 +mz_00003 420.16 HMDB41514 C18H26O10 402.152597052 0.02642 +mz_00003 420.16 HMDB01260 C21H35N9O15P2 715.172784519 0.026511 +mz_00003 420.16 HMDB10336 C15H21NO9 359.121631275 0.026971 +mz_00003 420.16 HMDB29452 C15H21NO9 359.121631275 0.026971 +mz_00003 420.16 HMDB33107 C16H20N2O6 336.132136382 0.027246 +mz_00003 420.16 HMDB37997 C21H21O12 465.103301136 0.027859 +mz_00003 420.16 HMDB15576 C6H12N3PS 189.048954601 0.028268 +mz_00003 420.16 HMDB61129 C17H17ClO5 336.076451361 0.028439 +mz_00003 420.16 HMDB31826 C39H62NO16 800.406859941 0.028647 +mz_00003 420.16 HMDB15178 C19H22FN3O4 375.159434412 0.029406 +mz_00003 420.16 HMDB04645 C10H16N4O7S 336.073969576 0.03092 +mz_00003 420.16 HMDB41257 C20H18O9 402.095082174 0.031095 +mz_00003 420.16 HMDB39332 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB37437 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB32910 C36H36O18 756.190164348 0.031095 +mz_00003 420.16 HMDB39609 C21H20O4 336.136159128 0.031269 +mz_00003 420.16 HMDB35501 C21H20O4 336.136159128 0.031269 +mz_00003 420.16 HMDB02250 C19H37NO4 343.272258677 0.031299 +mz_00003 420.16 HMDB29332 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB33524 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB29827 C20H19NO4 337.131408101 0.031778 +mz_00003 420.16 HMDB14970 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB02302 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB29738 C11H11NO2 189.078978601 0.03178 +mz_00003 420.16 HMDB12201 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB12202 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB12203 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB41369 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB32000 C16H23N5O6 381.164833493 0.032009 +mz_00003 420.16 HMDB37688 C9H12N2O3 196.08479226 0.032705 +mz_00003 420.16 HMDB32852 C9H12N2O3 196.08479226 0.032705 +mz_00003 420.16 HMDB33965 C15H27NO10 381.163496089 0.033346 +mz_00003 420.16 HMDB40866 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB36938 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB40664 C16H20O9 356.110732238 0.033503 +mz_00003 420.16 HMDB31025 C41H62O15 794.408871314 0.033654 +mz_00003 420.16 HMDB01162 C49H58FeN4O5 838.375663119 0.035108 +mz_00003 420.16 HMDB32382 C19H23N3O3 341.173941617 0.035162 +mz_00003 420.16 HMDB05026 C18H21N3O3S 359.130362243 0.035702 +mz_00003 420.16 HMDB30394 C16H25NO9 375.152931403 0.035909 +mz_00003 420.16 HMDB15107 C22H24ClN3O 381.160790112 0.036052 +mz_00003 420.16 HMDB14717 C17H18N2O6S 378.088557008 0.03762 +mz_00003 420.16 HMDB38228 C13H23NO9 337.137281339 0.037651 +mz_00003 420.16 HMDB12286 C8H15NO2S 189.082349419 0.038522 +mz_00003 420.16 HMDB61100 C14H19N5O5 337.138618743 0.038989 +mz_00003 420.16 HMDB01117 C12H23N2O9PS 402.086187546 0.039989 +mz_00003 420.16 HMDB41986 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB61220 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB61221 C19H24N4O3 356.184840654 0.040606 +mz_00003 420.16 HMDB59631 C14H12O 196.088815006 0.04075 +mz_00003 420.16 HMDB00715 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB60331 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB60332 C10H7NO3 189.042593095 0.040991 +mz_00003 420.16 HMDB14411 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34129 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34039 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB34049 C19H12O6 336.063388116 0.041502 +mz_00003 420.16 HMDB37373 C39H32O16 756.169034976 0.04166 +mz_00003 420.16 HMDB41231 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB36900 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB41349 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB35053 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB41002 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB34474 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB30657 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB29542 C22H26O7 402.167853186 0.041676 +mz_00003 420.16 HMDB36694 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB36945 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB34016 C22H26O7 402.167853186 0.041676 +mz_00003 420.16 HMDB36897 C20H26O7 378.167853186 0.041676 +mz_00003 420.16 HMDB60871 C44H55NO14 821.362255473 0.041678 +mz_00003 420.16 HMDB60870 C44H55NO14 821.362255473 0.041678 +mz_00003 420.16 HMDB33356 C21H26NO4 356.186183325 0.041948 +mz_00003 420.16 HMDB41519 C20H20N2O3 336.147392516 0.042503 +mz_00003 420.16 HMDB01132 C11H16NO9P 337.056267627 0.043362 +mz_00003 420.16 HMDB14739 C16H20FN3O4 337.143784348 0.044154 +mz_00003 420.16 HMDB59612 C11H17N5O8P 378.081474057 0.044703 +mz_00003 420.16 HMDB31833 C17H14ClN3O2S 359.049525104 0.045135 +mz_00003 420.16 HMDB13929 C16H16ClNO3S 337.05394178 0.045688 +mz_00003 420.16 HMDB29684 C7H6N4O2 178.049075456 0.046084 +mz_00003 420.16 HMDB39318 C42H62O17 838.398700558 0.046626 +mz_00003 420.16 HMDB31714 C7H14OS2 178.04860645 0.047022 +mz_00003 420.16 HMDB60667 C24H25NO 343.193614427 0.047346 +mz_00003 420.16 HMDB61086 C24H25NO 343.193614427 0.047346 +mz_00003 420.16 HMDB40241 C11H16OS 196.092185824 0.047492 +mz_00003 420.16 HMDB41088 C26H27NO7 465.178752223 0.047592 +mz_00003 420.16 HMDB01956 C40H40N4O14 800.254102008 0.047732 +mz_00003 420.16 HMDB60775 C16H13ClFNO4 337.051713821 0.047916 +mz_00003 420.16 HMDB61718 C21H28N2OS 356.192234218 0.047999 +mz_00003 420.16 HMDB14645 C21H23ClFNO2 375.140134897 0.048705 +mz_00003 420.16 HMDB00150 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB01353 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB01385 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB02541 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB03466 C6H10O6 178.047738052 0.048759 +mz_00003 420.16 HMDB39724 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB39726 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB29938 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB39722 C12H20O12 356.095476104 0.048759 +mz_00003 420.16 HMDB29932 C6H10O6 178.047738052 0.048759 +mz_00004 780.32 HMDB31947 C17H23NO8 369.142366717 0.001444 +mz_00004 780.32 HMDB35940 C44H44O9 716.298533006 0.005702 +mz_00004 780.32 HMDB33906 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB39032 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB32731 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB39575 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB32105 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB35108 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB30081 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB36780 C20H24O7 376.152203122 0.007526 +mz_00004 780.32 HMDB15535 C16H26N2O5S 358.156242642 0.00825 +mz_00004 780.32 HMDB33715 C68H112O37 1520.688244598 0.009339 +mz_00004 780.32 HMDB14038 C21H20FNO4 369.137636338 0.010904 +mz_00004 780.32 HMDB38999 C17H26O6S 358.145009254 0.014216 +mz_00004 780.32 HMDB00244 C17H20N4O6 376.138284392 0.020311 +mz_00004 780.32 HMDB35698 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB35467 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB38113 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB41276 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB30573 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB30709 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB35789 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB36837 C20H22O6 358.141638436 0.020958 +mz_00004 780.32 HMDB40600 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB33300 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB33301 C16H24O10 376.136946988 0.022986 +mz_00004 780.32 HMDB06676 C54H89N3O41 1435.497149365 0.024328 +mz_00004 780.32 HMDB01069 C16H18N6O4 358.138953094 0.026329 +mz_00004 780.32 HMDB33084 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB36765 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB61331 C21H23NO5 369.157622851 0.029069 +mz_00004 780.32 HMDB38971 C19H24N2O6 376.16343651 0.029993 +mz_00004 780.32 HMDB00768 C14H23NO11 381.127110583 0.031956 +mz_00004 780.32 HMDB33932 C23H20O5 376.13107375 0.034732 +mz_00004 780.32 HMDB38229 C37H40N4O11 716.269358142 0.034877 +mz_00004 780.32 HMDB15107 C22H24ClN3O 381.160790112 0.035403 +mz_00004 780.32 HMDB29788 C24H24O4 376.167459256 0.038039 +mz_00004 780.32 HMDB29299 C32H40O17 696.226549854 0.03834 +mz_00004 780.32 HMDB61254 C38H41N3O11S 747.246179859 0.040331 +mz_00004 780.32 HMDB61256 C38H41N3O11S 747.246179859 0.040331 +mz_00004 780.32 HMDB33965 C15H27NO10 381.163496089 0.040815 +mz_00004 780.32 HMDB12364 C36H66NO10P 703.442433849 0.041474 +mz_00004 780.32 HMDB12344 C36H66NO10P 703.442433849 0.041474 +mz_00004 780.32 HMDB06606 C29H49NO23 779.269536879 0.043187 +mz_00004 780.32 HMDB13001 C54H92O46 1476.485975556 0.043189 +mz_00004 780.32 HMDB12201 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB41369 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB12202 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB12203 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB32000 C16H23N5O6 381.164833493 0.04349 +mz_00004 780.32 HMDB29401 C20H19NO6 369.121237345 0.043702 +mz_00004 780.32 HMDB33522 C21H19NO6 381.121237345 0.043702 +mz_00004 780.32 HMDB29360 C20H19NO6 369.121237345 0.043702 +mz_00005 956.25 HMDB35451 C43H49O23 933.266462874 0.005681 +mz_00005 956.25 HMDB38095 C43H49O23 933.266462874 0.005681 +mz_00005 956.25 HMDB40803 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB02219 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB38821 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB40511 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB34149 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB33990 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB35931 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB29617 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB36630 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB41455 C22H22O10 446.121296924 0.008359 +mz_00005 956.25 HMDB60157 C30H52N7O18P3S 923.230238121 0.013727 +mz_00005 956.25 HMDB33021 C43H49O22 917.271548252 0.015294 +mz_00005 956.25 HMDB41153 C40H41O22 873.208947996 0.019318 +mz_00005 956.25 HMDB60375 C35H54N7O19P3S 1001.240802807 0.019643 +mz_00005 956.25 HMDB35163 C40H42O26 938.196431516 0.019745 +mz_00005 956.25 HMDB29794 C40H42O26 938.196431516 0.019745 +mz_00005 956.25 HMDB04047 C27H44N7O19P3S 895.162552487 0.022108 +mz_00005 956.25 HMDB40378 C45H38O21 914.190558278 0.025619 +mz_00005 956.25 HMDB14756 C21H21ClN2O8 464.098643365 0.029593 +mz_00005 956.25 HMDB12207 C28H42N7O17P3S 873.157073179 0.032557 +mz_00005 956.25 HMDB35883 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB37932 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB34725 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB33132 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB40478 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB34360 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB37362 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB30775 C21H20O12 464.095476104 0.035928 +mz_00005 956.25 HMDB30747 C22H24O11 464.13186161 0.036843 +mz_00005 956.25 HMDB37535 C22H24O11 464.13186161 0.036843 +mz_00005 956.25 HMDB14927 C28H54GdN5O20 938.260314726 0.044138 +mz_00006 1100.45 HMDB60499 C28H30N4O6 518.216534712 0.001166 +mz_00006 1100.45 HMDB32198 C30H34Cl2N4O 536.210967144 0.004946 +mz_00006 1100.45 HMDB06568 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB02060 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB06582 C20H35NO15 529.200669455 0.014838 +mz_00006 1100.45 HMDB10345 C27H36O11 536.225761994 0.024644 +mz_00006 1100.45 HMDB36888 C27H36O11 536.225761994 0.024644 +mz_00006 1100.45 HMDB39422 C48H64N11O18 1082.443079299 0.026902 +mz_00006 1100.45 HMDB35520 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB38923 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB29773 C24H38O12 518.23632668 0.038418 +mz_00006 1100.45 HMDB15455 C53H67N9O10S 1021.473160099 0.04438 +mz_00006 1100.45 HMDB40723 C30H30O8 518.194067936 0.046099 +mz_00006 1100.45 HMDB01980 C46H65N13O12S2 1055.431705989 0.047134 +mz_00006 1100.45 HMDB33282 C26H32O12 536.189376488 0.048127 +mz_00006 1100.45 HMDB33281 C26H32O12 536.189376488 0.048127 +mz_00006 1100.45 HMDB15595 C28H22F3N7O 529.183792976 0.048591
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/wsdl_hmdb.pl Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,265 @@ +#!perl + +## script : wsdl_hmdb.pl +#============================================================================= +# Included modules and versions +#============================================================================= +## Perl modules +use strict ; +use warnings ; +use Carp qw (cluck croak carp) ; + +use Data::Dumper ; +use Getopt::Long ; +use Text::CSV ; +use POSIX ; +use FindBin ; ## Permet de localisez le repertoire du script perl d'origine + +## Specific Modules (Home made...) +use lib $FindBin::Bin ; +my $binPath = $FindBin::Bin ; +use lib::hmdb qw( :ALL ) ; +## PFEM Perl Modules +use lib::conf qw( :ALL ) ; +use lib::csv qw( :ALL ) ; + +## Initialized values +my ( $help ) = undef ; +my ( $mass ) = undef ; +my ( $masses_file, $col_id, $col_mass, $header_choice, $nbline_header ) = ( undef, undef, undef, undef, undef ) ; +my ( $delta, $molecular_species, $out_tab, $out_html, $out_xls ) = ( undef, undef, undef, undef, undef ) ; + + +#============================================================================= +# Manage EXCEPTIONS +#============================================================================= + +&GetOptions ( "h" => \$help, # HELP + "mass:s" => \$mass, ## option : one masse + "masses:s" => \$masses_file, ## option : path to the input + "header_choice:s" => \$header_choice, ## Presence or not of header in tabular file + "nblineheader:i" => \$nbline_header, ## numbre of header line present in file + "colfactor:i" => \$col_mass, ## Column id for retrieve formula list in tabular file + "delta:f" => \$delta, + "mode:s" => \$molecular_species, ## Molecular species (positive/negative/neutral) + "output|o:s" => \$out_tab, ## option : path to the ouput (tabular : input+results ) + "view|v:s" => \$out_html, ## option : path to the results view (output2) + "outputxls:s" => \$out_xls, ## option : path to the xls-like format output + ) ; + +#============================================================================= +# EXCEPTIONS +#============================================================================= +$help and &help ; + +#============================================================================= +# MAIN SCRIPT +#============================================================================= + + +## -------------- Conf file ------------------------ : +my ( $CONF ) = ( undef ) ; +foreach my $conf ( <$binPath/*.cfg> ) { + my $oConf = lib::conf::new() ; + $CONF = $oConf->as_conf($conf) ; +} + +## -------------- HTML template file ------------------------ : +foreach my $html_template ( <$binPath/*.tmpl> ) { $CONF->{'HTML_TEMPLATE'} = $html_template ; } + + +## --------------- Global parameters ---------------- : +my ( $ids, $masses, $results ) = ( undef, undef, undef ) ; +my ( $complete_rows, $nb_pages_for_html_out ) = ( undef, 1 ) ; +my $search_condition = "Search params : Molecular specie = $molecular_species / delta (mass-to-charge ratio) = $delta" ; + +## --------------- retrieve input data -------------- : + +## manage only one mass +if ( ( defined $mass ) and ( $mass ne '' ) ) { + my @masses = split(" ", $mass); + $masses = \@masses ; + for (my $i=1 ; $i<=$#masses+1 ; $i++){ push (@$ids,"mz_0".sprintf("%04s", $i ) ); } +} ## END IF +## manage csv file containing list of masses +elsif ( ( defined $masses_file ) and ( $masses_file ne "" ) and ( -e $masses_file ) ) { + ## parse all csv for later : output csv build + my $ocsv_input = lib::csv->new() ; + my $complete_csv = $ocsv_input->get_csv_object( "\t" ) ; + $complete_rows = $ocsv_input->parse_csv_object($complete_csv, \$masses_file) ; + + ## parse masses and set ids + my $ocsv = lib::csv->new() ; + my $csv = $ocsv->get_csv_object( "\t" ) ; + if ( ( !defined $nbline_header ) or ( $nbline_header < 0 ) ) { $nbline_header = 0 ; } + $masses = $ocsv->get_value_from_csv_multi_header( $csv, $masses_file, $col_mass, $header_choice, $nbline_header ) ; ## retrieve mz values on csv + my $nbmz = @$masses ; + for (my $i=1 ; $i<=$nbmz+1 ; $i++){ push (@$ids,"mz_0".sprintf("%04s", $i ) ); } +} +else { + warn "[warning] Input data are missing : none mass or file of masses\n" ; + &help ; +} + +## ---------------- launch queries -------------------- : + +if ( ( defined $delta ) and ( $delta > 0 ) and ( defined $molecular_species ) and ( $molecular_species ne '' ) ) { + ## prepare masses list and execute query + my $oHmdb = lib::hmdb::new() ; + my $hmdb_pages = undef ; + + $results = [] ; # prepare arrays ref + my $submasses = $oHmdb->extract_sub_mz_lists($masses, $CONF->{HMDB_LIMITS} ) ; + + ## get the hmdb server status by a test query - continuous queries or kill script. + my $status = $oHmdb->test_matches_from_hmdb_ua() ; + $oHmdb->check_state_from_hmdb_ua($status) ; ## can kill the script execution + + foreach my $mzs ( @{$submasses} ) { + + my $result = undef ; + my ( $hmdb_masses, $nb_masses_to_submit ) = $oHmdb->prepare_multi_masses_query($mzs) ; + $hmdb_pages = $oHmdb->get_matches_from_hmdb_ua($hmdb_masses, $delta, $molecular_species) ; + $result = $oHmdb->parse_hmdb_csv_results($hmdb_pages, $mzs) ; ## hash format result + + $results = [ @$results, @$result ] ; + } + + ## Uses N mz and theirs entries per page (see config file). + # how many pages you need with your input mz list? + $nb_pages_for_html_out = ceil( scalar(@{$masses} ) / $CONF->{HTML_ENTRIES_PER_PAGE} ) ; + +# print Dumper $results ; +} +else { + croak "Can't work with HMDB : missing paramaters (list of masses, delta or molecular species)\n" ; +} ## end ELSE + +## -------------- Produce HTML/CSV output ------------------ : + +if ( ( defined $out_html ) and ( defined $results ) ) { + my $oHtml = lib::hmdb::new() ; + my ($tbody_object) = $oHtml->set_html_tbody_object( $nb_pages_for_html_out, $CONF->{HTML_ENTRIES_PER_PAGE} ) ; + ($tbody_object) = $oHtml->add_mz_to_tbody_object($tbody_object, $CONF->{HTML_ENTRIES_PER_PAGE}, $masses, $ids) ; + ($tbody_object) = $oHtml->add_entries_to_tbody_object($tbody_object, $CONF->{HTML_ENTRIES_PER_PAGE}, $masses, $results) ; + my $output_html = $oHtml->write_html_skel(\$out_html, $tbody_object, $nb_pages_for_html_out, $search_condition, $CONF->{'HTML_TEMPLATE'}, $CONF->{'JS_GALAXY_PATH'}, $CONF->{'CSS_GALAXY_PATH'}) ; + +} ## END IF +else { + warn "Can't create a HTML output for HMDB : no result found or your output file is not defined\n" ; +} + +if ( ( defined $out_tab ) and ( defined $results ) ) { + # produce a csv based on METLIN format + my $ocsv = lib::hmdb::new() ; + if (defined $masses_file) { + my $lm_matrix = undef ; + if ( ( defined $nbline_header ) and ( $header_choice eq 'yes' ) ) { +# $lm_matrix = $ocsv->set_lm_matrix_object('hmdb', $masses, $results ) ; + $lm_matrix = $ocsv->set_hmdb_matrix_object_with_ids('hmdb', $masses, $results ) ; + $lm_matrix = $ocsv->add_lm_matrix_to_input_matrix($complete_rows, $lm_matrix, $nbline_header-1) ; + } + elsif ( ( $header_choice eq 'no' ) ) { +# $lm_matrix = $ocsv->set_lm_matrix_object(undef, $masses, $results ) ; + $lm_matrix = $ocsv->set_hmdb_matrix_object_with_ids(undef, $masses, $results ) ; + $lm_matrix = $ocsv->add_lm_matrix_to_input_matrix($complete_rows, $lm_matrix, 0) ; + } + $ocsv->write_csv_skel(\$out_tab, $lm_matrix) ; + } + elsif (defined $mass) { + $ocsv->write_csv_one_mass($masses, $ids, $results, $out_tab) ; + } +} ## END IF +else { + warn "Can't create a tabular output for HMDB : no result found or your output file is not defined\n" ; +} + +## Write XLS like format +if ( ( defined $out_xls ) and ( defined $results ) ) { + my $ocsv = lib::hmdb::new() ; + $ocsv->write_csv_one_mass($masses, $ids, $results, $out_xls) ; +} + + +#==================================================================================== +# Help subroutine called with -h option +# number of arguments : 0 +# Argument(s) : +# Return : 1 +#==================================================================================== +sub help { + print STDERR " +help of wsdl_hmdb + +# wsdl_hmdb is a script to query HMDB website using mz and return a list of candidates sent by HMDB based on the ms search tool. +# Input : formula or list of formula +# Author : Franck Giacomoni and Marion Landi +# Email : fgiacomoni\@clermont.inra.fr +# Version : 1.4 +# Created : 08/07/2012 +# Updated : 21/01/2016 +USAGE : + wsdl_hmdb.pl -mass [one mass or a string list of exact masses] -delta [mz delta] -mode [molecular species: positive|negative|neutral] -output [output tabular file] -view [output html file] + + or + wsdl_hmdb.pl -masses [an input file of mzs] -colfactor [col of mz] -header_choice [yes|no] -nblineheader [nb of lines containing file header : 0-n] + -delta [mz delta] -mode [molecular species: positive|negative|neutral] -output [output tabular file] -view [output html file] + + or + wsdl_hmdb.pl -h for help + + "; + exit(1); +} + +## END of script - F Giacomoni + +__END__ + +=head1 NAME + + wsdl_hmdb.pl -- script to query HMDB website using mz and return a list of candidates sent by HMDB based on the ms search tool. + +=head1 USAGE + + wsdl_hmdb.pl -mass [one mass or a string list of exact masses] -delta [mz delta] -mode [molecular species: positive|negative|neutral] -output [output tabular file] -view [output html file] + + or + wsdl_hmdb.pl -masses [an input file of mzs] -colfactor [col of mz] -header_choice [yes|no] -nblineheader [nb of lines containing file header : 0-n] + -delta [mz delta] -mode [molecular species: positive|negative|neutral] -output [output tabular file] -view [output html file] + +=head1 SYNOPSIS + +This script manages batch queries on HMDB server. + +=head1 DESCRIPTION + +This main program is a script to query HMDB website using mz and return a list of candidates sent by HMDB based on the ms search tool. + +=over 4 + +=item B<function01> + +=item B<function02> + +=back + +=head1 AUTHOR + +Franck Giacomoni E<lt>franck.giacomoni@clermont.inra.frE<gt> + +=head1 LICENSE + +This program is free software; you can redistribute it and/or modify it under the same terms as Perl itself. + +=head1 VERSION + +version 1.0 : 06 / 06 / 2013 + +version 1.2 : 27 / 01 / 2014 + +version 1.3 : 19 / 11 / 2014 + +version 1.4 : 21 / 01 / 2016 - a clean version for community + +=cut \ No newline at end of file
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/hmdb/wsdl_hmdb.xml Thu Jan 28 10:52:26 2016 -0500 @@ -0,0 +1,239 @@ +<tool id="wsdl_hmdb" name="HMDB MS search" version="2016-01-28"> + <description> + search by masses on HMDB online bank + </description> + <command interpreter="perl"> + wsdl_hmdb.pl + #if str($input_type.choice) == "YES": + -masses "${input_type.masses}" + -header_choice "${input_type.header.header_choice}" + #if str($input_type.header.header_choice) == "yes": + -nblineheader "${$input_type.header.nbHeader}" + #end if + -colfactor "${input_type.colfactor}" + #else: + -mass "${input_type.mass}" + #end if + -delta "$delta" -mode "$mode" + -output "$variableMetadata" -view "$HmdbResView" -outputxls "$HmdbResXls" + </command> + <inputs> + <conditional name="input_type"> + <param name="choice" type="select" label="Would you use a file " help="if 'NO' is selected then one or more mass(es) must be entered manually"> + <option value="YES">YES</option> + <option value="NO">NO</option> + </param> + <when value="YES"> + <param name="masses" label="File of masses (Variable Metadata) " format="tabular" type="data" help="Generally variable metadata file. Please note : HMDB allows maximum 150 query masses per request" /> + <conditional name="header"> + <param name="header_choice" type="select" label="Do you have a header " help="if 'YES' is selected then enter your number of header lines"> + <option value="no">NO</option> + <option value="yes" selected="true">YES</option> + </param> + <when value="yes"> + <param name="nbHeader" label="Number of header lines " type="integer" value="1" min="1" size="10" help="number of lines not containing masses"/> + </when> + </conditional> + <param name="colfactor" label="Column of masses " type="data_column" data_ref="masses" accept_default="true" /> + </when> + <when value="NO"> + <param name="mass" label="Mass to submit " type="text" size="20" help="For a masses list, writes : m1 m2 m3. Your values must be separated by spaces. You should use dot (.) like decimal separator" /> + </when> + </conditional> + + <param name="delta" label="Mass-to-charge ratio " type="float" value="0.05" min="0" max="10" size="10" help="Default value is 0.05 for HMDB (mass-to-charge ratio)"/> + <param name="mode" label="Molecular Species " type="select" display="radio" help=""> + <option value="positive">Positif Mode</option> + <option value="negative">Negatif Mode</option> + <option value="neutral" selected="True">Neutral Mass</option> + </param> + </inputs> + + <outputs> + <data name="variableMetadata" format="tabular" label="${tool.name}_TSV"/> + <data name="HmdbResView" format="html" label="${tool.name}_VIEW"/> + <data name="HmdbResXls" label="${tool.name}_XLS" format="tabular" /> + </outputs> + + <tests> + <test> + <!--test 01 no result - fake-mzrt-input-with-id --> + <param name="choice" value="YES"/> + <param name="masses" value="input_test01_fake-mzrt-input-with-id.tsv"/> + <param name="header_choice" value="yes"/> + <param name="nblineheader" value="1"/> + <param name="colfactor" value="2"/> + <param name="delta" value="0.001"/> + <param name="mode" value="neutral"/> + <output name="variableMetadata" file="out_test01.tsv"/> + <output name="HmdbResView" file="out_test01.html"/> + <output name="HmdbResXls" file="out_test01.csv"/> + </test> + <test> + <!--test 02 : some results - with-mzrt-input-with-id file--> + <param name="choice" value="YES"/> + <param name="masses" value="input_test02_mzrt-input-with-id.tsv"/> + <param name="header_choice" value="yes"/> + <param name="nblineheader" value="1"/> + <param name="colfactor" value="2"/> + <param name="delta" value="0.001"/> + <param name="mode" value="positive"/> + <output name="variableMetadata" file="out_test02.tsv"/> + <output name="HmdbResView" file="out_test02.html"/> + <output name="HmdbResXls" file="out_test02.csv"/> + </test> + <test> + <!--test 03 : some results - with-mz list in manual mass mode--> + <param name="choice" value="NO"/> + <param name="mass" value="175.01 238.19 420.16 780.32 956.25 1100.45"/> + <param name="delta" value="0.05"/> + <param name="mode" value="positive"/> + <output name="variableMetadata" file="out_test03.tsv"/> + <output name="HmdbResView" file="out_test03.html"/> + <output name="HmdbResXls" file="out_test03.csv"/> + </test> + </tests> + + <help> + +.. class:: infomark + +**Authors** Marion Landi and Franck Giacomoni + +--------------------------------------------------- + +.. class:: infomark + +**Please cite** If you use this tool, please cite + | `Wishart DS, Jewison T, Guo AC, Wilson M, Knox C, et al., HMDB 3.0—The Human Metabolome Database in 2013. Nucleic Acids Res. 2013. <http://www.ncbi.nlm.nih.gov/pubmed/23161693>`_ + + +--------------------------------------------------- + +============== +HMDB MS search +============== + +----------- +Description +----------- + + | Search informations (like : HMDB id, Name, Adduct, delta mass) on HMDB online bank + | with one or more mass(es) in a file or entered manually + + +----------------- +Workflow position +----------------- + + +.. image:: ./static/images/metabolomics/hmdb.png + :width: 800 + + +----------- +Input files +----------- + + ++-------------------------+-----------+ +| Parameter : num + label | Format | ++=========================+===========+ +| 1 : File of masses | tabular | ++-------------------------+-----------+ + +File of masses (Generally variable metadata file) must have at least the following column : + * Masses : column with all the masses in the tsv input file + +---------- +Parameters +---------- + +Would you use a file + | Choose whether the masses are in a file or entered manually + | YES (default) : parameters **File of masses ; Do you have a header ; Column of masses** are visible + | NO : parameter **Mass to submit** is visible + | + + +If 'use file'='YES' + +File of masses + | see "Input files" section above + | Tabular file format, Generally variable metadata file + | + +Do you have a header + | YES (default) : parameter **Number of header lines** is visible + | NO : all lines are considered to contain masses + | + +If 'have a header'='YES' + +Number of header lines + | Number of lines not containing masses values, these lines will be ignored + | + +In all header cases : + +Column of masses + | Specify the column number for the mass in the tsv input file + | + + +If 'use file'='NO' + +Mass to submit + | Specify a list of mass to request + | one or more mass(es) entered manually + | For a masses list, writes : m1 m2 m3 + | You must separate yours values with space + | dot (.) is for float number + | + +In all cases : + +Mass-to-charge ratio + | Specify a delta (mass-to-charge ratio) to apply on mass - This value is a float, between 0.0000000000000001 and 10. + | + +Molecular Species + | Type of ionization of the molecule : *positif, negatif, neutral* + | + + +------------ +Output files +------------ + +Two types of files + | wsdl_hmdb_VIEW.HTML : for viewing result via HTML. + | + | wsdl_hmdb_TSV.tabular : for linking with others modules. + | + | an excel-like output will be available. + | + +--------------------------------------------------- + + +--------------- +Working example +--------------- + + +.. class:: warningmark + +Refer to the corresponding `"W4M HowTo" <http://workflow4metabolomics.org/howto>`_ page: + | Format Data For Postprocessing + | Perform LCMS Annotations + +.. class:: warningmark + +And their "W4M courses 2015": + | Using Galaxy4Metabolomics - W4M table format for Galaxy + | Annotation Banks - Annotation + + + </help> +</tool> \ No newline at end of file