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Analysis: LC/Electro-spray /QTOF positive ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
10-HYDROXYDECANOATE10-Hydroxydecanoic acidME64321474300C02774--
12-HYDROXY-DODECANOIC ACID12-Hydroxy lauric acidME64321579034C08317--
[13C]-ISOLEUCINEIsoleucineME6432126306---
[13C]-LEUCINELeucineME6432136106---
17ALPHA-HYDROXYPROGESTERONE17alpha-HydroxyprogesteroneME6432166238C01176--
1-METHYLADENOSINE1-MethyladenosineME64321727476C02494--
1-NAPHTHYLAMINE1-NaphthylamineME6432188640C14790--
2',4'-DIHYDROXYACETOPHENONE2',4'-DihydroxyacetophenoneME6432196990C03663--
25-HYDROXYCHOLESTEROL25-HydroxycholesterolME64322453477807C15519--
2`-DEOXYADENOSINE 5`-DIPHOSPHATEdADPME643220188966C00206--
2'-DEOXYADENOSINE 5'-MONOPHOSPHATEdAMPME64322512599C00360--
2'-DEOXYCYTIDINEDeoxycytidineME64322613711C00881--
2`-DEOXYCYTIDINE 5`-DIPHOSPHATEdCDPME643221150855C00705--
2'-DEOXYCYTIDINE 5'-MONOPHOSPHATEdCMPME64322713945C00239--
2-DEOXY-D-GLUCOSE2-Deoxy-glucoseME643228439268C00586--
2`-DEOXYGUANOSINEDeoxyguanosineME643222187790C00330--
2'-DEOXYGUANOSINE 5'-DIPHOSPHATEdGDPME643229439220C00361--
2`-DEOXYGUANOSINE 5`-MONOPHOSPHATEdGMPME64322365059C00362--
2-HYDROXYPHENYLACETIC ACID2-Hydroxyphenylacetic acidME64323011914C01983--
2-METHYLPROPANAL OXIME2-Methylpropanal oximeME6432319023C03219--
2-QUINOLINECARBOXYLIC ACIDQuinaldic acidME6432327124C06325--
3,5-DIIODO-L-TYROSINE3,5-Diiodo-L-tyrosineME6432346181C01060--
3ALPHA-HYDROXY-5BETA-CHOLANATELithocholic acidME6432359903C03990--
3'-CMP3'-CMPME64323666535C05822--
3-(CYSTEIN-S-YL)ACETAMINOPHEN (*)3-(Cystein-S-yl)acetaminophenME643233171264---
3-DEHYDROSHIKIMATE3-DehydroshikimateME643237439774C02637--
3-HYDROXYANTHRANILATE3-Hydroxyanthranilic acidME64323886C00632--
4-ACETAMIDOBUTANOATE4-Acetamidobutanoic acidME64323918189C02946--
4-AMINOBENZOATEp-Aminobenzoic acidME643240978C00568--
4-COUMARATEcis-p-Coumaric acidME643241637542C00811--
4-GUANIDINOBUTANOIC ACID4-Guanidinobutanoic acidME643242500C01035--
4-METHYLCATECHOL4-MethylcatecholME6432439958C06730--
4-NITROPHENYL PHOSPHATE4-Nitrophenyl phosphateME643244378C03360--
4-QUINOLINECARBOXYLIC ACID4-Quinolinecarboxylic acidME64324510243C06414--
5ALPHA-PREGNANE-3,20-DIONE5alpha-Pregnane-3,20-dioneME64324792810C03681--
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-D-RIBOFURANO...AICARME64324965110C04677--
5-Aminoimidazole ribotideAIRME643248161500C03373--
5BETA-DIHYDROTESTOSTERONE5beta-DihydrotestosteroneME64325015C05293--
5-HYDROXY-L-TRYPTOPHAN5-Hydroxy-tryptophanME643251439280C01017--
5-HYDROXYMETHYLURACIL5-HydroxymethyluracilME64325278168C03088--
5-HYDROXYPENTANOIC ACID5-Hydroxyvaleric acidME64325325945C02804--
5-METHYLCYTOSINE5-MethylcytosineME64325465040C02376--
5`-METHYLTHIOADENOSINE5'-MethylthioadenosineME643246439176C00170--
5-OXO-PROLINEPyroglutamic acidME643255499C01879--
5-VALEROLACTONE5-ValerolactoneME64325610953C02240--
6,7-DIHYDROBIOPTERIN4a-Carbinolamine tetrahydrobiopterinME643257133246C00268--
7-AMINOCEPHALOSPORANIC ACID7-Aminocephalosporanic acidME643258441328C07756--
ACETOACETATEAcetoacetic acidME64325996C00164--
ADENINEAdenineME643260190C00147--
ADENOSINEAdenosineME64326160961C00212--
ADENOSINE 3',5'-CYCLIC MONOPHOSPHATE3',5' cyclic AMPME6432626076C00575--
ADENOSINE 5'-MONOPHOSPHATEAMPME6432646083C00020--
ADENOSINE 5`-TRIPHOSPHATEATPME6432635957C00002--
ADP-RIBOSEADP-riboseME643265192C00301--
ALANINEAlanineME6432665950C01401--
ALLANTOATEAllantoic acidME643267203C00499--
ALPHA-KETO-GLUTARATE2-Oxoglutaric acidME64326851C00026--
ALPHA-LIPOAMIDELipoamideME643269863C00248--
ALPHA-TOCOPHEROLalpha-TocopherolME64327014985C02477--
ANDROSTERONEAndrosteroneME6432715879C00523--
ANTHRANILATE2-Aminobenzoic acidME643272227C00108--
ARACHIDONOYLGLYCEROPHOSPHOCHOLINELPC 20:4ME64327324779476C05208--
ASCORBATEVitamin CME64327454670067C00072--
ASPARAGINEAsparagineME6432756267C16438--
BILIVERDINBiliverdinME6432765280353C00500--
BIOPTERINBiopterinME643277445040C06313--
BIOTINBiotinME643278171548C00120--
BIS(2-ETHYLHEXYL)PHTHALATEBis(2-ethylhexyl)phthalateME6432798343C03690--
BISPHOSPHOGLYCERATE2,3-Diphosphoglyceric acidME643280186004C01159--
BOC-ASN-ME64328182035C01410--
CAFFEIC ACIDCaffeic acidME6432821549111C01481--
CAPECITABINECapecitabineME64328360953C12650--
CITRAMALATECitramalic acidME6432841081C00815--
CITRATECitric acidME643285311C00158--
CITRULLINECitrullineME6432869750C00327--
CORTICOSTERONECorticosteroneME6432875753C02140--
CORTISOL 21-ACETATECortisol 21-acetateME6432885744C02821--
CREATINECreatineME643289586C00300--
CYCLOHEX-1-ENECARBOXYLIC ACIDCyclohex-1-enecarboxylic acidME64329069470C12101--
CYCLOHEXANE-1,3-DIONECyclohexane-1,3-dioneME64329110434C01066--
CYSTEINECysteineME643292594C00736--
CYSTINECystineME643293595C01420--
CYTIDINECytidineME6432946175C00475--
CYTIDINE 2`,3`-CYCLIC MONOPHOSPHATE (CCMP)2',3' cyclic CMPME64329568934C02354--
CYTIDINE 5`-DIPHOSPHATECDPME6432966132C00112--
CYTIDINE 5'-DIPHOSPHOCHOLINECDP-cholineME64329813804C00307--
CYTIDINE 5`-MONOPHOSPHATECMPME6432976131C00055--
CYTOSINECytosineME643299597C00380--
DEOXYCHOLATEDeoxycholic acidME643300222528C04483--
DEOXYCORTICOSTERONE ACETATEDeoxycorticosterone acetateME6433015952C14554--
DEOXYRIBOSEDeoxyriboseME6433029828112C01801--
DGTPdGTPME64330365103C00286--
DIETHANOLAMINEDiethanolamineME6433048113C06772--
DIHYDROFOLATEDihydrofolic acidME64330598792C00415--
DIHYDROTHYMINEDihydrothymineME64330693556C00906--
DIMETHYLARGININEDimethylarginineME643307123831C03626--
DIMETHYLBENZIMIDAZOLEDimethylbenzimidazoleME643308675C03114--
DIPALMITOYLGLYCEROLDG 16:0_16:0ME643309644078C00165--
DOCOSAHEXAENOIC ACIDDocosahexaenoic acidME643310445580C06429--
DOCOSAHEXAENOYLGLYCEROPHOSPHOCHOLINELPE 22:6ME64331153480465C04230--
ERYTHRITOLErythritolME643312222285C00503--
ESTRADIOL 17 ALPHAEstradiol-17alphaME64331368570C02537--
ESTRIOLEstriolME6433143269C05141--
ESTRONEEstroneME6433155870C00468--
FLAVIN ADENINE DINUCLEOTIDEFADME643316643975C00016--
FOLIC ACIDFolic acidME6433176037C00504--
FORMYL-L-METHIONINEN-FormylmethionineME6433186995182C03145--
FRUCTOSE 1,6-BIPHOSPHATEFructose 1,6-bisphosphateME643319172313C00354--
GDP-GLUCOSEGDP-glucoseME643320644106C00394--
GLUCOSAMINE 6-PHOSPHATEGlucosamine 6-phosphateME643321439217C00352--
GLUCOSE-6-PHOSPHATEGlucose 6-phosphateME6433225958C00092--
GLUTAMIC ACIDGlutamic acidME64332333032C00302--
GLUTAMINEGlutamineME6433245961C00303--
GLUTARATEGlutaric acidME643325743C00489--
GLUTATHIONE OXIDIZEDGlutathioneME643326975C00127--
GLUTATHIONE REDUCEDGlutathioneME643327124886C00051--
GLYCERIC ACIDGlyceric acidME643328439194C00258--
GLYCEROPHOSPHOCHOLINEsn-Glycero-3-phosphocholineME643329657272C00670--
GLYCINEGlycineME643330750C00037--
GLYCOCHOLATEGlycocholic acidME64333110140C01921--
GUANINEGuanineME643332764C00242--
GUANOSINEGuanosineME6433336802C00387--
GUANOSINE 3`,5`-CYCLIC MONOPHOSPHATE3',5' cyclic GMPME64333424316C00942--
GUANOSINE 5`-DIPHOSPHATEGDPME6433368977C00035--
GUANOSINE 5' MONOPHOSPHATEGMPME6433356804C00144--
HEPTADECANOYLGLYCEROPHOSPHOCHOLINELPC 17:0ME64333753480465C04230--
HEXOSEHexoseME643338206C00738--
HIPPURATEHippuric acidME643339464C01586--
HISTIDINEHistidineME6433406274C00768--
HISTIDINOLL-HistidinolME643341165271C00860--
HOMOCYSTEINEHomocysteineME643342778C05330--
HOMOGENTISATEHomogentisic acidME643343780C00544--
HOMOSERINEHomoserineME64334412647C00263--
HOMOSTACHYDRINE(S)-HomostachydrineME643345441447C08283--
HOMOVANILLATEHomovanillic acidME6433461738C05582--
HYPOXANTHINEHypoxanthineME643347790C00262--
INDOLE-3-ACETALDEHYDEIndoleacetaldehydeME643348800C00637--
INDOLE-3-ETHANOLTryptophanolME64334910685C00955--
INDOLEPYRUVATEIndolepyruvateME643350803C00331--
INOSINEInosineME6433516021C00294--
INOSINE 5'-MONOPHOSPHATEIMPME6433528582C00130--
ISOCITRIC ACIDIsocitric acidME6433531198C00311--
ISOLEUCINEIsoleucineME6433546306C16434--
KYNURENIC ACIDKynurenic acidME6433553845C01717--
KYNURENINEKynurenineME643356161166C01718--
LEUCINELeucineME6433576106C16439--
LINOLEOYLGLYCEROPHOSPHOCHOLINELPC 18:2ME6433585280646C04100--
LINOLEOYLGLYCEROPHOSPHOCHOLINE (*)LPC 18:2ME6433595280646C04100--
LL-2,6-DIAMINOHEPTANEDIOATE2,6-Diaminopimelic acidME6433601549100C00666--
LUMICHROMELumichromeME6433615326566C01727--
LYSINELysineME6433625962C16440--
MALEAMATEMaleamateME6433635364140C01596--
MANNOSE-6-PHOSPHATEMannose 6-phosphateME643364439198C00275--
MENAQUINONEMenaquinoneME6433655280374C00828--
METHIONINEMethionineME6433666137C01733--
METHYL BETA-D-GALACTOSIDEMethyl beta-D-galactosideME64336794214C03619--
METHYLGUANIDINEMethylguanidineME64336910111C02294--
METHYL JASMONATEMethyl jasmonateME6433685281929C11512--
MYRISTOYLGLYCEROPHOSPHOCHOLINELPC 14:0ME643370460604C04230--
N6-(DELTA2-ISOPENTENYL)-ADENINEN6-IsopentenyladenineME64337192180C04083--
N-ACETYL-BETA-D-GLUCOSAMINYLAMINEN-Acetyl-beta-glucosaminylamineME643372439454C01239--
N-ACETYL-L-ASPARTIC ACIDN-Acetylaspartic acidME64337365065C01042--
N-ACETYL-L-LEUCINEN-AcetylleucineME64337475619C02710--
N-ACETYLNEURAMINATEN-Acetylneuraminic acidME643375439197C00270--
N-ACETYLPUTRESCINEN-AcetylputrescineME643376122356C02714--
N-ACETYLSEROTONINN-AcetylserotoninME643377903C00978--
N-CYCLOHEXYLFORMAMIDEN-CyclohexylformamideME64337813017C11519--
N-ETHYLMALEIMIDEN-EthylmaleimideME6433794362C02441--
NICOTINAMIDENiacinamideME643380936C00153--
NICOTINAMIDE ADENINE DINUCLEOTIDENAD+ME64338110897651C00003--
NICOTINAMIDE MONONUCLEOTIDENicotinamide ribotideME64338214180C00455--
NICOTINENicotineME643383942C16150--
N-METHYLTYRAMINEN-MethyltyramineME6433849727C02442--
O-ACETYL-L-CARNITINECAR 2:0ME6433851C02571--
OCTANOYLCARNITINECAR 8:0ME643386123701C02838--
OLEOYLGLYCEROPHOSPHOCHOLINELPC 18:1ME6433875280634C03916--
ORNITHINEOrnithineME6433886262C01602--
OXOMALONATEMesoxalic acidME64338910132C00830--
PALMITOYLCARNITINE (*)CAR 16:0ME64339011953816C02990--
PALMITOYLGLYCEROPHOSPHOCHOLINELPC 16:0ME643391460602C04102--
PALMITOYLGLYCEROPHOSPHOCHOLINE (*)LPC 16:0ME643392460602C04102--
PANTOLACTONEPantolactoneME643393439368C01012--
PANTOTHENIC ACIDPantothenic acidME643394988C00864--
PHENYLACETYLGLUTAMINEalpha-N-PhenylacetylglutamineME64339592258C04148--
PHOSPHOCHOLINECholine phosphateME643396135437C00588--
PIMELIC ACIDPimelic acidME643397385C02656--
PIPERINEPiperineME643398638024C03882--
PROLINEProlineME643399145742C16435--
PROPIONYLCARNITINECAR 3:0ME643400188824C03017--
PTERINPterinME64340173000C00715--
PUTRESCINEPutrescineME6434021045C00134--
PYRIDOXALPyridoxalME6434031050C00250--
PYRIDOXAL 5`-PHOSPHATEPyridoxal 5'-phosphateME6434041051C00018--
PYRIDOXAMINEPyridoxamineME6434051052C00534--
PYRIDOXINEPyridoxineME6434061054C00314--
QUINATEQuinic acidME6434076508C00296--
QUINOLINEQuinolineME6434082165C06413--
RAFFINOSERaffinoseME643409439242C00492--
RETINOATERetinoic acidME643410444795C00777--
RETINOLRetinolME643411445354C00473--
RIBULOSE 1,5-BISPHOSPHATERibulose 1,5-bisphosphateME643412123658C01182--
ROSMARINIC ACIDRosmarinic acidME6434135281792C01850--
S-ADENOSYL-L-HOMOCYSTEINES-AdenosylhomocysteineME643415439155C00021--
S-ADENOSYL METHIONINES-AdenosylmethionineME64341434755C00019--
S-HEXYL-GLUTATHIONES-Hexyl-glutathioneME64341697536C02886--
SHIKIMATEShikimic acidME6434178742C00493--
SPERMIDINESpermidineME6434181102C00315--
SPERMINESpermineME6434191103C00750--
SPHINGANINESphinganineME64342091486C00836--
SPHINGOSINESphingosineME6434215280335C00319--
STACHYOSEStachyoseME643422439531C01613--
STEARAMIDEStearamideME64342331292C13846--
STEAROYL SPHINGOMYELINSM 18:1;O2/18:0ME6434246453725C00550--
SUBERIC ACIDSuberic acidME64342510457C08278--
SUCCINATESuccinic acidME6434261110C00042--
TAURINETaurineME6434271123C00245--
TESTOSTERONETestosteroneME6434286013C00535--
THYMIDINEThymidineME6434295789C00214--
TRANS-CYCLOHEXANE-1,2-DIOLtrans-Cyclohexane-1,2-diolME64343092886C03739--
TRYPTOPHANTryptophanME6434316305C00806--
TRYPTOPHANAMIDETryptophanamideME643432439356C00977--
TYROSINETyrosineME6434336057C01536--
URATEUric acidME6434341175C00366--
UREAUreaME6434351176C00086--
URIDINEUridineME6434366029C00299--
URIDINE 5`-DIPHOSPHO-N-ACETYLGLUCOSAMINEUDP-N-acetylglucosamineME643437445675C00043--
URIDINE-5-MONOPHOSPHATEUMPME6434386030C00105--
UROCANATEUrocanic acidME6434391549103C00785--
VALINEValineME6434406287C16436--
VITAMIN B12Vitamin B12ME64344116212801C05776--
VITAMIN D3Vitamin D3ME64344210883523C05443--
XANTHINEXanthineME6434431188C00385--
XANTHOSINE 5`-MONOPHOSPHATEXMPME64344473323C00655--
XANTHURENIC ACIDXanthurenic acidME6434455699C02470--


Analysis: LC/Electro-spray /QTOF negative ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
11BETA,21-DIHYDROXY-5BETA-PREGNANE-3,20-DIONE11beta,21-Dihydroxy-5beta-pregnane-3,20-dioneME64344944263339C05475--
11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE11beta-Hydroxyandrost-4-ene-3,17-dioneME64345094141C05284--
13(S)-HPODE13S-HpODEME6434511426C04717--
15(S)-HETE15S-HETEME6434525280724C04742--
17BETA-HYDROXYANDROSTAN-3-ONE5alpha-DihydrotesosteroneME64345310635C03917--
1-AMINOCYCLOPROPANE-1-CARBOXYLATE1-Aminocyclopropanecarboxylic acidME643454535C01234--
1-HYDROXY-2-NAPHTHOATE1-Hydroxy-2-naphthoateME6434556844C03203--
2,3,5,6-TETRACHLOROPHENOL2,3,5,6-TetrachlorophenolME64345613636C15505--
2,5-DIOXOPIPERAZINECyclo(Gly-Gly)ME6434577817C02777--
2-CARBOXY-2,3-DIHYDRO-5,6-DIHYDROXYINDOLELeucodopachromeME643460161255C05604--
2`-DEOXYADENOSINE 5`-TRIPHOSPHATEdATPME64345815993C00131--
2'-DEOXYURIDINE 5'-MONOPHOSPHATEdUMPME64346165063C00365--
2`-DEOXYURIDINE 5`-TRIPHOSPHATEUTPME6434596133C00460--
2-HYDROXYBUTYRIC ACID2-Hydroxybutyric acidME64346211266C05984--
2-HYDROXYGLUTARATE2-Hydroxyglutaric acidME64346343C02630--
2-OXO-3-HYDROXY-4-PHOSPHOBUTANOATE2-Oxo-3-hydroxy-4-phosphobutanoic acidME64346425245610C06054--
2-OXOADIPATEOxoadipic acidME64346571C00322--
3-(2-HYDROXYPHENYL)PROPANOATE3-(2-Hydroxyphenyl)propanoic acidME643466873C01198--
3,4-DIHYDROXYBENZOATEProtocatechuic acidME64346872C00230--
3,4-DIHYDROXYPHENYL GLYCOL3,4-DihydroxyphenylglycolME64346991528---
3-(4-HYDROXYPHENYL)LACTATEHydroxyphenyllactic acidME6434679378C03672--
3ALPHA,7ALPHA,12ALPHA-TRIHYDROXY-5BETA-CHOLESTANOA...Coprocholic acidME643470440460C04722--
3ALPHA,7ALPHA-DIHYDROXY-5BETA-CHOLESTANATE3alpha,7alpha-Dihydroxy-5beta-cholestanoic acidME643471440384C04554--
3-HYDROXY-3-METHYLGLUTARATE3-Hydroxymethylglutaric acidME6434721662C03761--
3-HYDROXYANTHRANILATE3-Hydroxyanthranilic acidME64347386C00632--
3-HYDROXYBENZALDEHYDE3-HydroxybenzaldehydeME643474101C03067--
3-HYDROXYBENZYL ALCOHOL3-Hydroxybenzyl alcoholME643475102C03351--
3-HYDROXY-DL-KYNURENINEHydroxykynurenineME64347689C02794--
3-METHYL-2-OXOBUTANOIC ACIDKetoisovaleric acidME64347749C00141--
3-SULFINO-L-ALANINE3-Sulfino-alanineME6434781549098C00606--
4-(2-AMINO-3-HYDROXYPHENYL)-2,4-DIOXOBUTANOATE4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acidME643479440741C05645--
4-ACETAMIDOBUTANOATE4-Acetamidobutanoic acidME64348018189C02946--
4-AMINOBENZOATEp-Aminobenzoic acidME643481978C00568--
4-ANDROSTEN-3BETA,17BETA-DIOL DISULFATE4-Androsten-3beta,17beta-diol disulfateME64348210634C04295--
4-HYDROXY-3-METHOXY-BENZENEMETHANOL4-Hydroxy-3-methoxybenzenemethanolME64348362348C06317--
4-HYDROXY-3-METHOXYMANDELIC ACID-ME643484736172C05584--
4-HYDROXYPHENYLACETATE4-Hydroxyphenyl acetateME643485127C00642--
4-METHYL-2-OXO-PENTANOIC ACIDKetoleucineME64348670C00233--
4-NITROPHENOL4-NitrophenolME643487980C00870--
4-OXOGLUTARAMATE4-Oxoglutaramic acidME643488440726C05572--
4-PYRIDOXATE4-Pyridoxic acidME6434896723C00847--
5,6-DIHYDROURACILDihydrouracilME643490649C00429--
5-AMINOLEVULINIC ACID5-Amino-levulinic acidME643491137C00430--
5-HYDROXYINDOLE-3-ACETIC ACID5-Hydroxyindoleacetic acidME6434921826C05635--
5-OXO-PROLINEPyroglutamic acidME643493499C01879--
5-PHOSPHO-ALPHA-D-RIBOSEPhosphoribosyl pyrophosphateME6434947339C00119--
6-PHOSPHOGLUCONIC ACID6-Phosphogluconic acidME64349591493C00345--
9(10)-EPOME9(10)-EpOMEME6434965316080C14825--
ACENAPHTHENEQUINONEAcenaphthenequinoneME6434976724C02807--
ACETYLENEDICARBOXYLATEAcetylenedicarboxylateME643498371C03248--
ACONITATEtrans-Aconitic acidME643499444212C00417--
ADENINEAdenineME643500190C00147--
ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE3',5' cyclic AMPME6435016076C00575--
ADENOSINE 5`-DIPHOSPHATEADPME6435026022C00008--
ADENOSINE-5`-DIPHOSPHOGLUCOSEADP-glucoseME64350316500C00498--
ALDOSTERONEAldosteroneME6435045839C01780--
ANDROSTERONE GLUCURONIDEAndrosterone 3-glucuronideME643505114833C11135--
ARGININEArginineME6435066322C02385--
ASPARTATEAspartic acidME6435075960C16433--
AZELAIC ACIDAzelaic acidME6435082266C08261--
B-ALANYL-N(PAI)-METHYL-L-HISTIDINEAnserineME643509112072C01262--
BENZOATEBenzoic acidME643510243C00180--
BILIVERDINBiliverdinME6435115280353C00500--
[C13] PHENYLALANINEPhenylalanineME6434486140C02057--
CAPRYLIC ACIDCaprylic acidME643512379C06423--
CARNOSINECarnosineME643513439224C00386--
CHOLATECholic acidME643514221493C00695--
CITRATECitric acidME643515311C00158--
CITRULLINECitrullineME6435169750C00327--
CORTICOSTERONECorticosteroneME6435175753C02140--
CYCLOHEPTANECARBOXYLIC ACIDCycloheptanecarboxylic acidME64351815091C12104--
CYS-GLYCys-GlyME643519439498C01419--
CYSTATHIONINECystathionineME643520439258C00542--
CYSTEIC ACIDCysteic acidME64352172886C00506--
CYTIDINE 5`-TRIPHOSPHATECTPME6435226176C00063--
DECANOATECapric acidME6435232969C01571--
DEHYDROISOANDROSTERONE 3-SULFATEDehydroepiandrosterone sulfateME64352412594C04555--
DIHYDROXYACETONE PHOSPHATEDihydroxyacetone phosphateME643525668C00111--
DIMETHYLURATE1,7-Dimethyluric acidME64352691611C16356--
DOCOSAHEXAENOIC ACIDDocosahexaenoic acidME643527445580C06429--
DOCOSAPENTAENOATEDocosapentaenoic acidME6435285497182C16513--
DOPAMINE 3-O-SULFATEDopamine 3-O-sulfateME643529122136C13690--
ESTRADIOL-17BETAbeta-EstradiolME6435305757C00951--
FLAVIN ADENINE DINUCLEOTIDEFADME643531643975C00016--
FORMYL-L-METHIONINEN-FormylmethionineME6435326995182C03145--
FRUCTOSE 1,6-BIPHOSPHATEFructose 1,6-bisphosphateME643533172313C00354--
FUMARIC ACIDFumaric acidME643534444972C00122--
GAMMA-LINOLENIC ACIDgamma-Linolenic acidME6435355280933C06426--
GERANYL PYROPHOSPHATEGeranyl diphosphateME643536447277C00353--
GLUTAMIC ACIDGlutamic acidME64353733032C00302--
GLUTAMINEGlutamineME6435385961C00303--
GLYCERIC ACIDGlyceric acidME643539439194C00258--
GLYCOCHOLATEGlycocholic acidME64354010140C01921--
GLYCODEOXYCHOLATE / GLYCOCHENODEOXYCHOLATEGlycodeoxycholic acidME64354122833539C05464--
GLYOXALGlyoxalME6435427860C14448--
GLYOXYLATEGlyoxylic acidME643543760C00048--
GUANIDINOACETATEGuanidoacetic acidME643544763C00581--
GUANOSINE 5`-DIPHOSPHATEGDPME6435458977C00035--
GUANOSINE 5`-TRIPHOSPHATEGTPME6435466830C00044--
GULONO-1,4-LACTONED-GulonolactoneME643547165105C05410--
HEXADECANEDIOATEHexadecanedioic acidME64354810459C19615--
HEXANOATECaproic acidME6435498892C01585--
HIPPURATEHippuric acidME643550464C01586--
HYPOXANTHINEHypoxanthineME643551790C00262--
INDICANIndicanME64355292769C08481--
INOSINEInosineME6435536021C00294--
ISOLEUCINE/LEUCINELeucine/IsoleucineME6435546306C00407--
LAURIC ACIDLauric acidME6435553893C02679--
LIGNOCERIC ACIDLignoceric acidME64355611197C08320--
MALATEMalic acidME643557222656C00711--
MALONATEMalonic acidME643558867C00383--
MELATONINMelatoninME643559896C01598--
MERCAPTOPYRUVATE3-Mercaptopyruvic acidME64356098C00957--
METHIONINEMethionineME6435616137C01733--
METHYL BETA-D-GALACTOSIDEMethyl beta-D-galactosideME64356294214C03619--
MYO-INOSITOLMyo-inositolME643563892C00137--
MYRISTIC ACIDMyristic acidME64356411005C06424--
MYRISTOLEIC ACIDMyristoleic acidME6435655281119C08322--
N-ACETYL-D-GALACTOSAMINEN-Acetyl-D-galactosamineME64356635717C01132--
N-ACETYL-D-TRYPTOPHANN-Acetyl-D-tryptophanME643567439917C03137--
N-ACETYL-L-PHENYLALANINEN-AcetylphenylalanineME64356874839C03519--
N-ACETYLNEURAMINATEN-Acetylneuraminic acidME643569439197C00270--
NADPNADP+ME6435705886C00006--
N-BENZYLOXYCARBONYLGLYCINEN-BenzyloxycarbonylglycineME64357114349C03710--
NERVONIC ACIDNervonic acidME6435725281120C08323--
NICOTINIC ACID ADENINE DINUCLEOTIDE PHOSPHATENAADPME643573123953C13051--
N-METHYLTRYPTAMINEN-MethyltryptamineME6435746088C06213--
NONADECANOATE / METHYLSTEARATE (*)Nonadecylic acidME64357512591C16535--
NONANOATEPelargonic acidME6435768158C01601--
ORNITHINEOrnithineME6435776262C00515--
OROTATEOrotic acidME643578967C00295--
OROTIDINE 5`-MONOPHOSPHATEOrotidylic acidME643579160617C01103--
OXALATEOxalic acidME643580971C00209--
OXALOSUCCINATEOxalosuccinic acidME643581972C05379--
PALMITOLEIC ACIDPalmitoleic acidME643582445638C08362--
PANTOATE(R)-Pantoic acidME643583439251C00522--
PHENYLACETATEPhenyl acetateME643584999C07086--
PHENYLPYRUVATEPhenylpyruvic acidME643585997C00166--
PHOSPHATEPhosphoric acidME6435861004C00009--
PHOSPHOCREATINEPhosphocreatineME643588587C02305--
PHOSPHO(ENOL)PYRUVIC ACIDPhosphoenolpyruvic acidME6435871005C00074--
PHOSPHOETHANOLAMINEPhosphoethanolamineME6435891015C00346--
PHTHALATEPhthalic acidME6435901017C01606--
PHYTIC ACIDMyo-inositol hexakisphosphateME643591890C01204--
PREGNENOLONEPregnenoloneME6435938955C01953--
PREGN STEROID MONOSULFATEPregnenolone sulfateME643592105074C18044--
PROGESTERONEProgesteroneME6435945994C00410--
PROSTAGLANDIN G2PGG2ME6435955280883C05956--
PYRIDINE-2,3-DICARBOXYLATEQuinolinic acidME6435961066C03722--
PYRIDOXALPyridoxalME6435971050C00250--
PYRIDOXINEPyridoxineME6435981054C00314--
PYRUVATEPyruvic acidME6435991060C00022--
ROSMARINIC ACIDRosmarinic acidME6436005281792C01850--
(S)-DIHYDROOROTATE4,5-Dihydroorotic acidME643446648C00337--
SERINESerineME6436025951C00716--
S-(FORMYLMETHYL)GLUTATHIONES-(Formylmethyl)glutathioneME64360111954074C14871--
S-HEXYL-GLUTATHIONES-Hexyl-glutathioneME64360397536C02886--
(S)-LACTATELactic acidME643447107689C00186--
STACHYOSEStachyoseME643604439531C01613--
TARTARIC ACIDTartaric acidME643605444305C01534--
TAURINETaurineME6436061123C00245--
TAUROCHENODEOXYCHOLATETaurochenodeoxycholic acidME643607387316C05465--
TAUROCHOLATETaurocholic acidME6436086675C05122--
THIAMINE MONOPHOSPHATEThiamine monophosphateME6436093382778C01081--
THIAMINE PYROPHOSPHATEThiamine diphosphateME6436101132C00068--
THREONATEThreonic acidME643611151152C01620--
THYMIDINEThymidineME6436125789C00214--
THYROXINEThyroxineME6436135819C01829--
TRYPTOPHANTryptophanME6436146305C00078--
URACILUracilME6436151174C00106--
URIDINEUridineME6436166029C00299--
URIDINE 5`-DIPHOSPHOGLUCOSEUDP-glucoseME64361753477679C00029--
URIDINE 5`-DIPHOSPHOGLUCURONIC ACIDUDP-glucuronic acidME64361817473C00167--
URIDINE 5`-TRIPHOSPHATEUTPME6436196133C00075--
XANTHINEXanthineME6436201188C00385--
XANTHOSINE 5'-MONOPHOSPHATEXMPME64362173323C00655--


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