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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME45439279034C08317--
1-Aminocyclopropanecarboxylic acid1-Aminocyclopropanecarboxylic acidME454376535C01234--
1-Methyladenosine1-MethyladenosineME45426227476C02494--
2,3-Dihydroxypropyl tetradecanoate-ME45426379050CA1370--
2',4'-Dihydroxyacetophenone2',4'-DihydroxyacetophenoneME4542646990C03663--
2-acetomido-deoxy-glucosylamine-ME454377-CA1416--
2-Aminophenol2-AminophenolME454265-C01987--
2-deoxy-d-glucose2-Deoxy-glucoseME454378----
3-(2-Hydroxyphenyl)propanoic acid3-(2-Hydroxyphenyl)propanoic acidME454266873C01198--
3-Amino-5-hydroxybenzoic acid3-Amino-5-hydroxybenzoic acidME454267-C12107--
3-Hydroxycapric acid10-Hydroxydecanoic acidME45426826612C02774--
3-Methyldioxyindole3-MethyldioxyindoleME454269151066C05834--
3-Methylhistidine3-MethylhistidineME45437964969C01152--
4-Guanidinobutanoic acid4-Guanidinobutanoic acidME454270500C01035--
4-Hydroxy-L-prolinecis-4-HydroxyprolineME45427169248C01015--
4-Hydroxyphenylpyruvic acid4-Hydroxyphenylpyruvic acidME454272979C01179--
4-Trimethylammoniobutanoic acid3-DehydroxycarnitineME454273134C05543--
5-Aminolevulinic acid5-Amino-levulinic acidME454274137C00430--
5-Aminopentanoic acid5-Aminopentanoic acidME454275138C00431--
5-Hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME4542761826C05635--
5-Hydroxylysine5-HydroxylysineME4543804433C01211--
5'-Methylthioadenosine5'-MethylthioadenosineME454277439176C00170--
AcetylglycineN-AcetylglycineME45439010972CA1212--
AdenineAdenineME454278190C00147--
AdenosineAdenosineME45427960961C00212--
Adipic acidAdipic acidME454280196C06104--
AllantoinAllantoinME454281204C01551--
All-trans-retinoic acidRetinoic acidME454282444795C00777--
Aminoadipic acidAminoadipic acidME454283469C00956--
AnserineAnserineME454284112072C01262--
Beta-Alaninebeta-AlanineME454285239C00099--
BetaineBetaineME454286247C00719--
BiotinBiotinME454287171548C00120--
CarnosineCarnosineME454288439224C00386--
Cholic acidCholic acidME454289221493C00695--
CholineCholineME454290305C00114--
CitrullineCitrullineME4542919750C00327--
CorticosteroneCorticosteroneME4542925753C02140--
CortisolCortisolME454293657311C00735--
Cortisol 21-acetateCortisol 21-acetateME4543815744C02821--
CortisoneCortisoneME454294225609C00762--
CreatineCreatineME454295586C00300--
CreatinineCreatinineME454296588C00791--
CytosineCytosineME454297597C00380--
DeoxyguanosineDeoxyguanosineME454298187790C00330--
D-GalactosamineGalactosamineME454299739C02262--
Diaminopimelic acidDiaminopimelic acidME45430099290C00666--
DiethanolamineDiethanolamineME4543018113C06772--
D-LactoseLactoseME454382----
D-LyxoseLyxoseME4543023759C00476--
DopamineDopamineME454303681C03758--
EpinephrineEpinephrineME4543045816C00788--
Gamma-Aminobutyric acidgamma-Aminobutyric acidME454305119C00334--
glyceraldehyde 3-phosphate diethyl acetalGlyceraldehyde 3-phosphate diethyl acetalME454384-CA1402--
Glycerophosphocholinesn-Glycero-3-phosphocholineME45430671920C00670--
Glyceryl monoacetate-ME4543075283468---
GlycineGlycineME454308750C00037--
Glycocholic acidGlycocholic acidME45430923617285C01921--
Guanidoacetic acidGuanidoacetic acidME454310763C00581--
GuanineGuanineME454311764C00242--
GuanosineGuanosineME4543126802C00387--
Guanosine monophosphateGMPME4543136804C00144--
Hippuric acidHippuric acidME454314464C01586--
Homogentisic acidHomogentisic acidME454315780C00544--
HypoxanthineHypoxanthineME454316790C00262--
Indole-3-methyl acetateIndole-3-methyl acetateME45438374706CA1213--
Indoleacetic acidIndoleacetic acidME454317802C00954--
InosineInosineME4543186021C00294--
L-ArginineArginineME4543196322C00062--
L-AsparagineAsparagineME4543206267C00152--
L-Aspartic acidAspartic acidME4543215960C00049--
L-CarnitineCarnitineME4543222724480C00318--
Leukotriene B4LTB4ME4543235280492C02165--
L-Glutamic acidGlutamic acidME45432433032C00025--
L-GlutamineGlutamineME4543255961C00064--
L-HistidineHistidineME4543266274C00135--
L-KynurenineKynurenineME454327161166C00328--
L-LysineLysineME4543285962C00047--
L-MethionineMethionineME4543296137C00073--
L-NorleucineNorleucineME454385----
L-Norvaline2S-Aminopentanoic acidME4543307019097C01826--
L-PhenylalaninePhenylalanineME4543316140C00079--
L-ProlineProlineME454332145742C00148--
L-SerineSerineME4543335951C00065--
L-ThreonineThreonineME4543346288C00188--
L-TryptophanTryptophanME4543356305C00078--
L-TyrosineTyrosineME4543366057C00082--
LumichromeLumichromeME4543375326566C01727--
L-ValineValineME4543386287C00183--
N-acetyl-aspartic acidN-Acetylaspartic acidME454386----
N-Acetylglutamic acidN-Acetylglutamic acidME454388185C00624--
N-Acetyl-L-alanineN-AcetylalanineME45433988064C04341--
N-AcetylleucineN-AcetylleucineME45434070912C02710--
N-Acetyl-L-phenylalanineN-AcetylphenylalanineME45434174839C03519--
N-acetyl-serineN-AcetylserineME454389----
N-AcetylserotoninN-AcetylserotoninME454342903C00978--
N-acetyltryptophanN-Acetyl-tryptophanME454387700653C03137--
N-Alpha-acetyllysineN(2)-AcetyllysineME454343192590C12989--
NiacinamideNiacinamideME454344936C00153--
Nicotinic acidNicotinic acidME454345938C00253--
N-MethyltryptamineN-MethyltryptamineME4543466088C06213--
N,N,N-TrimethyllysineN-6-TrimethyllysineME454391-C03793--
NorepinephrineNorepinephrineME454347439260C00547--
Oleic acidOleic acidME454348445639C00712--
OrnithineOrnithineME4543496262C00077--
Ortho-Hydroxyphenylacetic acid-ME45435011970C05852--
Palmitic acidPalmitic acidME454351985C00249--
Pantothenic acidPantothenic acidME454352988C00864--
ParaxanthineParaxanthineME4543534687C13747--
PhenylacetaldehydePhenylacetaldehydeME454354998C00601--
PhenylethylaminePhenylethylamineME4543551001C05332--
PhosphocreatinePhosphocreatineME454356587C02305--
PhosphorylcholineCholine phosphateME4543571014C00588--
Pipecolic acidPipecolic acidME454358849C00408--
PutrescinePutrescineME4543591045C00134--
PyridoxaminePyridoxamineME4543601052C00534--
Pyroglutamic acidPyroglutamic acidME4543617405C01879--
Quinic acidQuinic acidME4543626508C00296--
SphinganineSphinganineME45436391486C00836--
Suberic acidSuberic acidME45436410457C08278--
TaurineTaurineME4543651123C00245--
tetrahydroxy-pregnan-20-one-ME454393----
TheobromineTheobromineME4543665429C07480--
ThymineThymineME4543671135C00178--
trans-Cinnamic acidtrans-Cinnamic acidME454368444539C00423--
TrigonellineTrigonellineME4543695570C01004--
TryptamineTryptamineME4543701150C00398--
UracilUracilME4543711174C00106--
Ureidopropionic acidUreidopropionic acidME454372111C02642--
Uric acidUric acidME4543731175C00366--
Urocanic acidUrocanic acidME454374736715C00785--
XanthineXanthineME4543751188C00385--


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME45439479034C08317--
1-Methyladenosine1-MethyladenosineME45439527476C02494--
2-Deoxy-D-Glucose2-Deoxy-glucoseME45439682756C00586--
2-Hydroxybutyric acid2-Hydroxybutyric acidME45447211266C05984--
3-(2-Hydroxyphenyl)propanoic acid3-(2-Hydroxyphenyl)propanoic acidME454397873C01198--
3-Hydroxy-2-methylglutarate-ME45447420070700CA1192--
3-Hydroxybenzoic acid3-Hydroxybenzoic acidME4543987420C00587--
3-Hydroxycapric acid10-Hydroxydecanoic acidME45439926612C02774--
3-Methyldioxyindole3-MethyldioxyindoleME454400151066C05834--
3-Sulfinoalanine3-Sulfino-alanineME454401439270C00606--
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME45440218189C02946--
AcetylglycineN-AcetylglycineME45447810972CA1212--
ADP-glucoseADP-glucoseME45440316500C00498--
AllantoinAllantoinME454404204C01551--
Alpha-D-GlucoseGlucoseME45440579025C00267--
Aminoadipic acidAminoadipic acidME454406469C00956--
Azelaic acidAzelaic acidME4544072266C08261--
Benzyl alcoholBenzyl alcoholME454408244C00556--
CarnosineCarnosineME454409439224C00386--
Citramalic acidCitramalic acidME454410441696C00815--
CitrullineCitrullineME4544119750C00327--
CreatineCreatineME454412586C00300--
D-Glucuronic acidGlucuronic acidME454413444791C00191--
Diaminopimelic acidDiaminopimelic acidME45441499290C00666--
Ethylmalonic acidEthylmalonic acidME45441511756C02170--
Formyl-L-methionyl peptideN-FormylmethionineME454475-C03145--
Galactaric acidGalactaric acidME4544163037582C00879--
Gentisic acidGentisic acidME4544733469C00628--
Glucaric acidGlucaric acidME45441733037C00818--
Gluconic acidGluconic acidME45441810690C00257--
Glucose 6-phosphateGlucose 6-phosphateME4544195958C00092--
Glyceric acidGlyceric acidME454420439194C00258--
Glycocholic acidGlycocholic acidME45442123617285C01921--
GuanineGuanineME454422764C00242--
Hippuric acidHippuric acidME454423464C01586--
Homogentisic acidHomogentisic acidME454424780C00544--
HypoxanthineHypoxanthineME454425790C00262--
Indoxyl sulfateIndoxyl sulfateME45442610258---
InosineInosineME4544276021C00294--
Isocitric acidIsocitric acidME4544281198C00311--
KetoleucineKetoleucineME45442970C00233--
L-ArginineArginineME4544306322C00062--
L-AsparagineAsparagineME4544316267C00152--
L-Aspartic acidAspartic acidME4544325960C00049--
L-CystineCystineME45443367678C00491--
L-Glutamic acidGlutamic acidME45443433032C00025--
L-HistidineHistidineME4544356274C00135--
L-HomoserineHomoserineME45443612647C00263--
L-Lactic acidLactic acidME45443761503C00256--
L-Malic acidMalic acidME454438222656C00149--
L-MethionineMethionineME4544396137C00073--
L-PhenylalaninePhenylalanineME4544406140C00079--
L-ProlineProlineME454441145742C00148--
L-SerineSerineME4544425951C00065--
L-TryptophanTryptophanME4544436305C00078--
L-TyrosineTyrosineME4544446057C00082--
LumichromeLumichromeME4544455326566C01727--
Malonic acidMalonic acidME454446867C00383--
N6-(delta2-Isopentenyl)-adenineN6-IsopentenyladenineME45444792180C04083--
N-Acetyl-L-methionineN-AcetylmethionineME4544486180C02712--
N-Acetyl-L-phenylalanineN-AcetylphenylalanineME45444974839C03519--
N-AcetylneuraminateN-Acetylneuraminic acidME4544503568C00270--
N-AcetylserineN-AcetylserineME45447765249CA1449--
N-acetyltryptophanN-Acetyl-tryptophanME454476700653C03137--
N-Alpha-acetyllysineN(2)-AcetyllysineME454451192590C12989--
O-PhosphoethanolaminePhosphoethanolamineME4544521015C00346--
Pantothenic acidPantothenic acidME454453988C00864--
p-Hydroxyphenylacetic acid4-Hydroxyphenylacetic acidME454454127C00642--
Pipecolic acidPipecolic acidME454455849C00408--
PyrocatecholPyrocatecholME454456289C00090--
Pyroglutamic acidPyroglutamic acidME4544577405C01879--
Quinic acidQuinic acidME4544586508C00296--
Rosmarinic acidRosmarinic acidME4544595281792C01850--
Shikimic acidShikimic acidME4544608742C00493--
Suberic acidSuberic acidME45446110457C08278--
Succinic acidSuccinic acidME4544621110C00042--
TaurineTaurineME4544631123C00245--
ThyroxineThyroxineME4544645819C01829--
trans-Aconitic acidtrans-Aconitic acidME454465444212C02341--
trans-Ferulic acidtrans-Ferulic acidME454466445858C01494--
UracilUracilME4544671174C00106--
Ureidopropionic acidUreidopropionic acidME454468111C02642--
UridineUridineME4544696029C00299--
Urocanic acidUrocanic acidME454470736715C00785--
XanthineXanthineME4544711188C00385--


Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,2-CyclohexanedioneCyclohexane-1,2-dioneME4545800C03739--
17a-EstradiolEstradiol-17alphaME45447968570C02537--
1-Methyladenosine1-MethyladenosineME45448027476C02494--
2,3-Dihydroxypropyl tetradecanoate-ME45448179050CA1370--
2,6-Dihydroxypyridine2,6-DihydroxypyridineME454482-C03056--
2-Aminobenzoic acid2-Aminobenzoic acidME454483227C00108--
2-Aminophenol2-AminophenolME454484-C01987--
4-Heptenal diethyl acetal4-Heptenal diethyl acetalME45448597750C04067--
4-Hydroxycinnamic acidcis-p-Coumaric acidME454486637542C00811--
4-Hydroxy-L-prolinecis-4-HydroxyprolineME45448769248C01015--
4-Trimethylammoniobutanoic acid3-DehydroxycarnitineME454488134C05543--
5-Aminolevulinic acid5-Amino-levulinic acidME454489137C00430--
5-Hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME4544901826C05635--
5-Hydroxylysine5-HydroxylysineME4545744433C01211--
5-Methylcytosine5-MethylcytosineME45449165040C02376--
5'-Methylthioadenosine5'-MethylthioadenosineME454492439176C00170--
AdenosineAdenosineME45449360961C00212--
AllantoinAllantoinME454494204C01551--
Alpha-Tocopherolalpha-TocopherolME45449514985C02477--
Beta-Alaninebeta-AlanineME454496239C00099--
BilirubinBilirubinME4544975280352C00486--
Caproic acidCaproic acidME4544988892C01585--
CarnosineCarnosineME454499439224C00386--
Cholesteryl acetateCholesteryl acetateME4545006427285C02530--
CinnamaldehydeCinnamaldehydeME454501637511C00903--
Citramalic acidCitramalic acidME454502441696C00815--
CitrullineCitrullineME4545039750C00327--
CreatineCreatineME454504586C00300--
DiethanolamineDiethanolamineME4545058113C06772--
DihydrouracilDihydrouracilME454506649C00429--
D-MannoseMannoseME45450718950C00159--
EthanolamineEthanolamineME454508700C00189--
Gamma-Linolenic acidgamma-Linolenic acidME4545095280933C06426--
Glycerol 3-phosphatesn-Glycero-3-phosphateME454510439162C00093--
Glycerophosphocholinesn-Glycero-3-phosphocholineME45451171920C00670--
Glyceryl monoacetate-ME4545125283468---
GlycineGlycineME454513750C00037--
Glycoaldehyde dimerGlycolaldehydeME454575-C00266--
Guanidoacetic acidGuanidoacetic acidME454514763C00581--
GuanineGuanineME454515764C00242--
GuanosineGuanosineME4545166802C00387--
Heptanoic acidHeptylic acidME4545178094C17714--
HistamineHistamineME454518774C00388--
Homogentisic acidHomogentisic acidME454519780C00544--
HypoxanthineHypoxanthineME454520790C00262--
Indole-3-methyl acetateIndole-3-methyl acetateME45452174706CA1231--
Indoleacetic acidIndoleacetic acidME454522802C00954--
InosineInosineME4545236021C00294--
L-AcetylcarnitineCAR 2:0ME4545241C02571--
L-AlanineAlanineME4545255950C00041--
L-AllothreonineAllothreonineME45452699289C05519--
L-ArginineArginineME4545276322C00062--
L-AsparagineAsparagineME4545286267C00152--
L-CarnitineCarnitineME4545292724480C00318--
L-Glutamic acidGlutamic acidME45453033032C00025--
L-GlutamineGlutamineME4545315961C00064--
L-HistidineHistidineME4545326274C00135--
L-HomoserineHomoserineME45453312647C00263--
L-IsoleucineIsoleucineME4545346306C00407--
LithocholyltaurineTaurolithocholic acidME45453553477716C02592--
L-LysineLysineME4545365962C00047--
L-MethionineMethionineME4545376137C00073--
L-NorleucineNorleucineME45453821236C01933--
L-PhenylalaninePhenylalanineME4545396140C00079--
L-ProlineProlineME454540145742C00148--
L-SerineSerineME4545415951C00065--
L-ThreonineThreonineME4545426288C00188--
L-TryptophanTryptophanME4545436305C00078--
L-TyrosineTyrosineME4545446057C00082--
LumichromeLumichromeME4545455326566C01727--
L-ValineValineME4545466287C00183--
MethylguanidineMethylguanidineME45454810111C02294--
Methyl jasmonateMethyl jasmonateME4545475367719C11512--
Mono Methyl gluataric acid-ME454576----
N-Acetyl-D-glucosamineN-Acetyl-D-glucosamineME454549439174C00140--
N-Acetyl-L-aspartic acidN-Acetylaspartic acidME45455065065C01042--
N-AcetylputrescineN-AcetylputrescineME454551122356C02714--
N-AcetylserotoninN-AcetylserotoninME454552903C00978--
N-acetyltryptophanN-Acetyl-tryptophanME454577700653C03137--
N-Alpha-acetyllysineN(2)-AcetyllysineME454553192590C12989--
NiacinamideNiacinamideME454554936C00153--
N-MethyltryptamineN-MethyltryptamineME4545556088C06213--
N,N-DimethylphenethylamineN,N-Dimethyl-1,4-phenylenediamineME45457886536C04203--
N,N,N-TrimethyllysineN-6-TrimethyllysineME454579-C03793--
Pantothenic acidPantothenic acidME454556988C00864--
ParaxanthineParaxanthineME4545574687C13747--
Phenylpyruvic acidPhenylpyruvic acidME454558997C00166--
Pipecolic acidPipecolic acidME454559849C00408--
PropanalPropanalME454560527C00479--
SalicylamideSalicylamideME4545615147CA1193--
SarcosineSarcosineME4545621088C00213--
SpermidineSpermidineME4545631102C00315--
Succinic acidSuccinic acidME4545641110C00042--
TheobromineTheobromineME4545655429C07480--
ThymidineThymidineME4545665789C00214--
trans-Cinnamic acidtrans-Cinnamic acidME454567444539C00423--
TrigonellineTrigonellineME4545685570C01004--
TrimethylamineTrimethylamineME4545691146C00565--
TryptophanamideTryptophanamideME45457089366C00977--
UracilUracilME4545711174C00106--
UridineUridineME4545726029C00299--
Urocanic acidUrocanic acidME454573736715C00785--


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,2-CyclohexanedioneCyclohexane-1,2-dioneME4547030C06105--
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME45458179034C08317--
1-Hydroxy-2-naphthoate1-Hydroxy-2-naphthoateME45458254675865C03203--
2',4'-Dihydroxyacetophenone2',4'-DihydroxyacetophenoneME4545836990C03663--
2-Aminophenol2-AminophenolME454584-C01987--
3-(2-Hydroxyphenyl)propanoic acid3-(2-Hydroxyphenyl)propanoic acidME454585873C01198--
3,4-Dihydroxybenzeneacetic acid3,4-Dihydroxybenzeneacetic acidME454586547C01161--
3-alpha,11-beta,17-alpha,21-tetrahydroxy- 5-alpha-...TetrahydrocortisolME454688-NA--
3alpha.12alpha-dihydroxy-5beta-cholanateDeoxycholic acidME454692-NA--
3-Aminoisobutanoic acid3-Aminoisobutanoic acidME45458764956C05145--
3-Hydroxybenzoic acid3-Hydroxybenzoic acidME4545887420C00587--
3-Hydroxycapric acid10-Hydroxydecanoic acidME45458926612C02774--
3-Hydroxymethylglutaric acid3-Hydroxymethylglutaric acidME4545901662C03761--
3-Hydroxyphenylacetic acid3-Hydroxyphenylacetic acidME45469012122C05593--
3-methyglutaric acidMethylglutaric acidME454691-NA--
3-Methyldioxyindole3-MethyldioxyindoleME454591151066C05834--
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME45459218189C02946--
4-Heptenal diethyl acetal4-Heptenal diethyl acetalME45459397750C04067--
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME454689126C00633--
4-Hydroxybenzoic acid4-Hydroxybenzoic acidME454594135C00156--
5-Hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME4545951826C05635--
Acetoacetic acidAcetoacetic acidME45459696C00164--
AdenosineAdenosineME45459760961C00212--
Adipic acidAdipic acidME454598196C06104--
AlloseAlloseME45469312285879C01487--
Alpha-D-GlucoseGlucoseME45459979025C00267--
Azelaic acidAzelaic acidME4546002266C08261--
Benzoic acidBenzoic acidME454601243C00180--
Benzyl alcoholBenzyl alcoholME454602244C00556--
Butyric acidButyric acidME454603264C00246--
Caffeic acidCaffeic acidME4546041549111C01481--
Caproic acidCaproic acidME4546058892C01585--
Caprylic acidCaprylic acidME454606379C06423--
Chenodeoxycholic acidChenodeoxycholic acidME45460710133C02528--
Cholic acidCholic acidME454608221493C00695--
CitrullineCitrullineME4546099750C00327--
CortisoneCortisoneME454610225609C00762--
Deoxycholic acidDeoxycholic acidME454611222528C04483--
DeoxycytidineDeoxycytidineME45461213711C00881--
DeoxyguanosineDeoxyguanosineME454613187790C00330--
D-FructoseFructoseME454695439709C02336--
D-GalactoseGalactoseME454696439357C00984--
Dihydroxyacetone phosphateDihydroxyacetone phosphateME454614668C00111--
D-LyxoseLyxoseME4546153759C00476--
D-MannoseMannoseME45461618950C00159--
D-RiboseRiboseME4546975779C00121--
D-TagatoseD-TagatoseME45469992092C00795--
D-XylitolXylitolME4547046912C00379--
D-XyloseXyloseME454700135191C00181--
Elaidic acidElaidic acidME454617637517C01712--
Ethylmalonic acidEthylmalonic acidME45461811756C02170--
GalactitolGalactitolME45461911850C01697--
Gentisic acidGentisic acidME4546873469C00628--
Gluconic acidGluconic acidME45462010690C00257--
Glutaric acidGlutaric acidME454621743C00489--
Glycerol 3-phosphatesn-Glycero-3-phosphateME454622439162C00093--
GuanineGuanineME454623764C00242--
Hippuric acidHippuric acidME454624464C01586--
Homogentisic acidHomogentisic acidME454625780C00544--
Homovanillic acidHomovanillic acidME4546261738C05582--
HydroquinoneHydroquinoneME454627785C00530--
Hydroxyphenyllactic acidHydroxyphenyllactic acidME4546289378C03672--
HypotaurineHypotaurineME454629107812C00519--
Imidazoleacetic acidImidazoleacetic acidME45463096215C02835--
Indoleacetic acidIndoleacetic acidME454631802C00954--
Indoxyl sulfateIndoxyl sulfateME45463210258---
InosineInosineME4546336021C00294--
Isobutyric acidIsobutyric acidME4546346590C02632--
KetoleucineKetoleucineME45463570C00233--
L-AllothreonineAllothreonineME45463699289C05519--
L-ArabinoseLyxoseME454694439195C02479--
L-ArabitolL-ArabitolME454637439255C00532--
L-ArginineArginineME4546386322C00062--
L-AsparagineAsparagineME4546396267C00152--
Leukotriene B4LTB4ME4546405280492C02165--
L-Glutamic acidGlutamic acidME45464133032C00025--
L-GlutamineGlutamineME4546425961C00064--
L-HomoserineHomoserineME45464312647C00263--
LithocholyltaurineTaurolithocholic acidME45464453477716C02592--
L-Lactic acidLactic acidME45464561503C00256--
L-SerineSerineME4546465951C00065--
L-SorboseSorboseME454701441484C08356--
L-ThreonineThreonineME4546476288C00188--
L-TyrosineTyrosineME4546486057C00082--
LumichromeLumichromeME4546495326566C01727--
L-ValineValineME4546506287C00183--
MannitolMannitolME4546516251C00392--
Methyl beta-D-glucopyranosideMethyl glucoseME4546522108C03619--
Methyl jasmonateMethyl jasmonateME4546535367719C11512--
Methylmalonic acidMethylmalonic acidME454654487C02170--
mono methyl glutarateMonomethyl glutaric acidME454702-NA--
myo-InositolMyo-inositolME454655892C00137--
N6-(delta2-Isopentenyl)-adenineN6-IsopentenyladenineME45465692180C04083--
N-AcetylleucineN-AcetylleucineME45465770912C02710--
N-Acetyl-L-phenylalanineN-AcetylphenylalanineME45465874839C03519--
OrnithineOrnithineME4546596262C00077--
Orotic acidOrotic acidME454660967C00295--
Ortho-Hydroxyphenylacetic acid-ME45466111970C05852--
Pantothenic acidPantothenic acidME454662988C00864--
Pelargonic acidPelargonic acidME4546638158C01601--
Petroselinic acid6-Octadecylenic acidME4546645461010C08363--
PhenylacetaldehydePhenylacetaldehydeME454665998C00601--
Phenylacetic acidPhenylacetic acidME454666999C07086--
p-Hydroxyphenylacetic acid4-Hydroxyphenylacetic acidME454667127C00642--
Pimelic acidPimelic acidME454668385C02656--
Protocatechuic acidProtocatechuic acidME45466972C00230--
Quinaldic acidQuinaldic acidME4546707124C06325--
Resorcinol monoacetateResorcinol monoacetateME454671-C12064--
RibitolRibitolME4546726912C00474--
SarcosineSarcosineME4546731088C00213--
SorbitolSorbitolME4546985780C00794--
Suberic acidSuberic acidME45467410457C08278--
Succinic acidSuccinic acidME4546751110C00042--
TheophyllineTheophyllineME4546762153C07130--
ThymineThymineME4546771135C00178--
trans-Cinnamic acidtrans-Cinnamic acidME454678444539C00423--
trans-Ferulic acidtrans-Ferulic acidME454679445858C01494--
TryptophanolTryptophanolME45468010685C00955--
UracilUracilME4546811174C00106--
Ureidopropionic acidUreidopropionic acidME454682111C02642--
Uric acidUric acidME4546831175C00366--
Urocanic acidUrocanic acidME454684736715C00785--
XanthineXanthineME4546851188C00385--
XanthosineXanthosineME45468664959C01762--


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