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Analysis: UPLC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
1-Methyladenosine1-MethyladenosineME516525----
1-Methyl-Histidine1-MethylhistidineME516364----
1-methylnicotinamide1-Methyl nicotinamideME516506----
2,3-dihydroxybenzoic acid2-Pyrocatechuic acidME516594----
2,3-Diphosphoglyceric acid2,3-Diphosphoglyceric acidME516450----
2-Aminooctanoic acid2-Aminocaprylic acidME516360----
2-dehydro-D-gluconate2-Dehydro-D-gluconic acidME516440----
2-deoxyglucose-6-phosphate2-Deoxy-D-glucose 6-phosphateME516462----
2-Hydroxy-2-methylbutanedioic acidCitramalic acidME516479----
2-Isopropylmalic acid2-Isopropylmalic acidME516482----
2-Ketohexanoic acid2-Ketocaproic acidME516597----
2-oxo-4-methylthiobutanoate2-Oxo-4-methylthiobutanoic acidME516411----
2-oxobutanoate3-Methyl pyruvic acidME516467----
3-hydroxy-3-methylglutaryl-CoA3-Hydroxy-3-methylglutaryl-CoAME516429----
3-hydroxybutyryl-CoA-ME516427----
3-methylphenylacetic acid3-Methylphenylacetic acidME516600----
3-Methylthiopropionate3-Methyl-thiopropionic acidME516410----
3-phosphoglycerate3-Phosphoglyceric acidME516439----
3-phospho-serinePhosphoserineME516370----
4-aminobutyrategamma-Aminobutyric acidME516338----
4-Pyridoxic acid4-Pyridoxic acidME516505----
5-methoxytryptophan5-MethoxytryptophanME516378----
5-Methyl-tetrahydrofolate5-Methyl-THFME516596----
5'-Methylthioadenosine5'-MethylthioadenosineME516403----
5-phosphoribosyl-1-pyrophosphatePhosphoribosyl pyrophosphateME516459----
6-phospho-D-gluconate6-Phosphogluconic acidME516451----
6-phospho-D-glucono-1,5-lactone-ME516445----
7,8-dihydrofolateDihydrofolic acidME516381----
7-methylguanosine7-MethylguanosineME516526----
acadesineAICARME516401----
acetoacetateAcetoacetic acidME516468----
acetoacetyl-CoAAcetoacetyl-CoAME516423----
acetyl-CoAAcetyl-CoAME516421----
AcetyllysineN(2)-AcetyllysineME516372----
acetylphosphateAcetylphosphateME516518----
aconitatetrans-Aconitic acidME516481----
adenineAdenineME516573----
adenosineAdenosineME516524----
Adenosine phosphosulfateAdenosine phosphosulfateME516550----
ADPADPME516551----
ADP-D-glucoseADP-glucoseME516568----
a-ketoglutarate2-Oxoglutaric acidME516478----
alanineAlanineME516337----
allantoateAllantoic acidME516389----
allantoinAllantoinME516601----
Alpha-ketoisovaleric acidKetoisovaleric acidME516471----
Aminoadipic acidAminoadipic acidME516388----
aminoimidazole carboxamide riboNucleotides-ME516595----
AMPAMPME516541----
anthranilate2-Aminobenzoic acidME516500----
arginineArginineME516366----
Ascorbic acidVitamin CME516501----
asparagineAsparagineME516350----
aspartateAspartic acidME516351----
ATPATPME516563----
Atrolactic acid-ME516593----
betaineBetaineME516332----
betaine aldehydeBetaine aldehydeME516396----
Beta-N-AcetylglucosamineN-AcetylglucosamineME516431----
biotinBiotinME516493----
butyryl-CoAButyryl-CoAME516426----
Carbamoyl phosphateCarbamoylphosphateME516507----
carnitineCarnitineME516361----
CDPCDPME516548----
CDP-cholineCDP-cholineME516561----
CDP-ethanolamineCDP-EthanolamineME516555----
CellobioseCellobioseME516457----
Cholesterol sulfateCholesterol sulfateME516515----
Cholic acidCholic acidME516514----
cholineCholineME516397----
Citraconic acidCitraconic acidME516474----
citrateCitric acidME516484----
Citric acidCitric acidME516487----
citrullineCitrullineME516367----
CMPCMPME516536----
coenzyme ACoenzyme AME516420----
creatineCreatineME516347----
creatinineCreatinineME516341----
CTPCTPME516559----
Cyclic AMP3',5' cyclic AMPME516545----
cyclic bis(3->5) dimeric GMP-ME516603----
cystathionineCystathionineME516377----
cysteineCysteineME516346----
CystineCystineME516379----
cytidineCytidineME516521----
cytosineCytosineME516571----
dAMPdAMPME516538----
dATPdATPME516562----
dCDPdCDPME516546----
dCMPdCMPME516534----
dCTPdCTPME516556----
deoxyadenosineDeoxyadenosineME516522----
Deoxycholic acidDeoxycholic acidME516513----
deoxyguanosineDeoxyguanosineME516523----
deoxyinosineDeoxyinosineME516532----
Deoxyribose 5-phosphateDeoxyribose 5-phosphateME516528----
deoxyuridineDeoxyuridineME516529----
dephospho-CoA3'-Dephospho-CoAME516419----
D-erythrose-4-phosphateErythrose 4-phosphateME516442----
dGDPdGDPME516552----
D-glucarateGlucaric acidME516443----
D-gluconateGluconic acidME516441----
D-glucosamine-1-phosphateGlucosamine 1-phosphateME516433----
D-glucosamine-6-phosphateGlucosamine 6-phosphateME516432----
D-Glyceraldehyde 3-phosphateGlyceraldehyde 3-phosphateME516436----
dGMPdGMPME516540----
dGTPdGTPME516564----
dihydroorotate4,5-Dihydroorotic acidME516387----
dihydroxy-acetone-phosphateDihydroxyacetone phosphateME516435----
DiiodothyronineDiiodothyronineME516382----
dimethylglycineDimethylglycineME516339----
DL-Pipecolic acidPipecolic acidME516333----
D-sedoheptulose-1-7-phosphateSedoheptulose 7-phosphateME516452----
dTDPdTDPME516547----
dTMPdTMPME516535----
dTTPdTTPME516558----
dUMPdUMPME516544----
dUTPdUTPME516557----
ethanolamineEthanolamineME516519----
FADFADME516498----
Farnesyl pyrophosphateFarnesyl diphosphateME516588----
FlavoneFlavoneME516585----
FMNFMNME516504----
folateFolic acidME516497----
Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME516455----
fructose-6-phosphateFructose 6-phosphateME516449----
fumarateFumaric acidME516469----
GDPGDPME516554----
Geranyl-PPGeranyl diphosphateME516587----
glucono-D-lactone-ME516437----
glucosamineGlucosamineME516430----
glucose-1-phosphateGlucose 1-phosphateME516447----
glucose-6-phosphateGlucose 6-phosphateME516448----
glutamateGlutamic acidME516357----
glutamineGlutamineME516355----
glutathioneGlutathioneME516495----
glutathione disulfideOxidized glutathioneME516391----
glutathione disulfide-1-ME516392----
glycerateGlyceric acidME516434----
Glyceric acid 1,3-biphosphateGlyceric acidME516602----
Glycerophosphocholinesn-Glycero-3-phosphocholineME516511----
glycineGlycineME516336----
glycolateGlycolic acidME516464----
glyoxylateGlyoxylic acidME516463----
GMPGMPME516543----
GTPGTPME516565----
Guanidoacetic acidGuanidoacetic acidME516384----
guanineGuanineME516574----
guanosineGuanosineME516575----
Guanosine diphosphateGDPME516569----
hexose-phosphateHexose 6-phosphateME516446----
histidineHistidineME516359----
histidinolL-HistidinolME516334----
homocysteic acidHomocysteic acidME516390----
homocysteineHomocysteineME516353----
homoserineHomoserineME516345----
Hydroxyisocaproic acidHydroxyisocaproic acidME516476----
Hydroxyphenylacetic acidHydroxyphenylacetic acidME516412----
hydroxyphenylpyruvate-ME516415----
hydroxyprolineHydroxyprolineME516348----
hypoxanthineHypoxanthineME516581----
IDPIDPME516553----
ImidazoleImidazoleME516394----
Imidazoleacetic acidImidazoleacetic acidME516395----
IMPIMPME516542----
indoleIndoleME516398----
Indole-3-carboxylic acidIndole-3-carboxylic acidME516589----
Indoleacrylic acidIndoleacrylic acidME516591----
inosineInosineME516533----
isocitrateIsocitric acidME516483----
Kynurenic acidKynurenic acidME516416----
KynurenineKynurenineME516400----
L-2-Hydroxyglutaric acid2-Hydroxyglutaric acidME516604----
L-AcetylcarnitineCAR 2:0ME516586----
lactateLactic acidME516466----
L-arginino-succinateArgininosuccinic acidME516380----
leucine-isoleucineLeucine/IsoleucineME516393----
lipoateLipoic acidME516489----
lysineLysineME516354----
malateMalic acidME516477----
Maleic acidMaleic acidME516470----
malonyl-CoAMalonyl-CoAME516424----
methionineMethionineME516358----
Methionine sulfoxideMethionine sulfoxideME516362----
MethylcysteineMethylcysteineME516352----
Methylmalonic acidMethylmalonic acidME516473----
myo-inositolMyo-inositolME516438----
N6-Acetyl-L-lysineN6-AcetyllysineME516371----
N-acetyl-glucosamine-1-phosphateN-Acetylglucosamine 1-phosphateME516453----
N-acetyl-glutamateN-Acetylglutamic acidME516374----
N-acetyl-glutamineN-AcetylglutamineME516373----
N-Acetyl-L-alanineN-AcetylalanineME516386----
N-AcetylornithineN-AcetylornithineME516365----
N-AcetylputrescineN-AcetylputrescineME516399----
NAD+NADME516508----
NADHNADHME516509----
NADP+NADPME516407----
NADPHNADPHME516408----
N-carbamoyl-L-aspartateCarbamoylaspartateME516368----
Ng,NG-dimethyl-L-arginineDimethylarginineME516375----
nicotinamideNiacinamideME516490----
Nicotinamide ribotideNicotinamide ribotideME516539----
nicotinateNicotinic acidME516499----
O-acetyl-L-serineO-AcetylserineME516356----
octulose-1,8-bisphosphate (OBP)-ME516460----
octulose-monophosphate (O8P-O1P)-ME516454----
OMP-ME516578----
ornithineOrnithineME516349----
orotateOrotic acidME516577----
oxaloacetateOxaloacetic acidME516475----
p-aminobenzoatep-Aminobenzoic acidME516598----
pantothenatePantothenic acidME516502----
phenylalaninePhenylalanineME516363----
Phenyllactic acidPhenyllactic acidME516414----
Phenylpropiolic acidPhenylpropiolic acidME516599----
phenylpyruvatePhenylpyruvic acidME516413----
phosphoenolpyruvatePhosphoenolpyruvic acidME516486----
PhosphorylcholineCholine phosphateME516517----
p-hydroxybenzoate4-Hydroxybenzoic acidME516592----
prephenatePrephenic acidME516485----
prolineProlineME516342----
propionyl-CoAPropionyl-CoAME516422----
purinePurineME516579----
PyridoxaminePyridoxamineME516491----
pyridoxinePyridoxineME516492----
Pyroglutamic acidPyroglutamic acidME516385----
PyrophosphatePyrophosphateME516510----
pyruvatePyruvic acidME516465----
quinolinateQuinolinic acidME516590----
riboflavinRiboflavinME516496----
ribose-phosphateRibose 5-phosphateME516444----
S-adenosyl-L-homoCysteineS-AdenosylhomocysteineME516405----
S-adenosyl-L-methionineS-AdenosylmethionineME516406----
S-AdenosylmethioninamineS-AdenosylmethioninamineME516404----
sarcosineSarcosineME516383----
Sedoheptulose 1,7-bisphosphate (SBP)-ME516458----
serineSerineME516340----
shikimateShikimic acidME516480----
Shikimate 3-phosphate3-Phosphoshikimic acidME516418----
sn-glycerol-3-phosphatesn-Glycero-3-phosphateME516512----
spermidineSpermidineME516335----
spermineSpermineME516409----
S-ribosyl-L-homocysteineS-RibosylhomocysteineME516402----
succinateSuccinic acidME516472----
succinyl-CoASuccinyl-CoAME516425----
succinyl-CoA-methylmalonyl-CoA-ME516428----
sucroseSucroseME516456----
taurineTaurineME516520----
Taurodeoxycholic acidTaurodeoxycholic acidME516516----
thiamineThiamineME516494----
Thiamine monophosphateThiamine monophosphateME516488----
Thiamine pyrophosphateThiamine diphosphateME516503----
threonineThreonineME516344----
thymidineThymidineME516530----
thymineThymineME516572----
trehalose-6-PhosphateTrehalose 6-phosphateME516461----
tryptophanTryptophanME516376----
tyrosineTyrosineME516369----
UDPUDPME516549----
UDP-D-glucoseUDP-glucoseME516566----
UDP-D-glucuronateUDP-glucuronic acidME516567----
UDP-N-acetyl-glucosamineUDP-N-acetylglucosamineME516570----
UMPUMPME516537----
uracilUracilME516576----
UreaUreaME516584----
Uric acidUric acidME516580----
uridineUridineME516531----
UTPUTPME516560----
valineValineME516343----
xanthineXanthineME516582----
xanthosineXanthosineME516583----
Xanthurenic acidXanthurenic acidME516417----
Xanthylic acidXMPME516527----


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