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Analysis: HILIC NEGATIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2-Oxobutyric acid3-Methyl pyruvic acidME873901---101.02
MalonateMalonic acidME874074--11.97103
alpha-hydroxybutyrate2-Hydroxybutyric acidME873939---103.04
L-SerineSerineME874064--12.14104.04
D-GlycerateGlyceric acidME873981--8.89105.02
HypotaurineHypotaurineME874037---108.01
CytosineCytosineME873974--9.76110.04
UracilUracilME874167---111.02
CreatinineCreatinineME873966--8.16112.05
L-ProlineProlineME874063--10.36114.06
FumarateFumaric acidME874006---115
trans-1,2-Cyclohexanedioltrans-Cyclohexane-1,2-diolME874156---115.08
N-acetylglycineN-AcetylglycineME874087--7.62116.04
GuanidinoacetateGuanidoacetic acidME874026--12.13116.05
5-aminovalerate5-Aminopentanoic acidME873920--12.01116.07
BetaineBetaineME873950--9.35116.07
L-ValineValineME874068--10.14116.07
NorvalineNorvalineME874109---116.07
Mesoxalic acidMesoxalic acidME874077---116.98
SuccinateSuccinic acidME874146---117.02
HomoserineHomoserineME874036---118.05
L-allothreonineAllothreonineME874050---118.05
L-ThreonineThreonineME874065--11.4118.05
Purine Base-ME874130--6.79119.04
L-CysteineCysteineME874054--12.6120.01
NicotinamideNiacinamideME874104---121.04
NicotinateNicotinic acidME874105--5.24122.02
TaurineTaurineME874148---124.01
2-Aminoethylphosphonic acidCiliatineME873899--12.47124.02
5-Methylcytosine5-MethylcytosineME873923--8.52124.05
Imidazoleacetic acidImidazoleacetic acidME874039--9.23125.04
ThymineThymineME874153---125.04
4-Oxoproline4-Oxo-prolineME873917---128.04
5-oxoprolinePyroglutamic acidME873925---128.04
Pipecolic acidPipecolic acidME874128--10.16128.07
MevalonolactoneMevalonolactoneME874082--4.81129.06
N-acetylputrescineN-AcetylputrescineME874090--14.25129.1
5-aminolevulinic acid5-Amino-levulinic acidME873919--6.77130.05
cis-4-Hydroxy-D-prolinecis-4-Hydroxy-D-prolineME873956--11.65130.05
N-AcetylalanineN-AcetylalanineME874083--6.78130.05
trans-4-Hydroxy-L-prolinetrans-4-HydroxyprolineME874157--11.44130.05
CreatineCreatineME873964---130.06
L-IsoleucineIsoleucineME874061---130.09
L-LeucineLeucineME874062---130.09
3-Ureidopropionic acidUreidopropionic acidME873912--9.64131.05
AsparagineAsparagineME873948--12.03131.05
OrnithineOrnithineME874114--15.34131.08
L-AspartateAspartic acidME874051--12.23132.03
D-MalateD-Malic acidME873982--12.59133.01
MalateMalic acidME874073---133.01
HomocysteineHomocysteineME874034--12.52134.03
AdenineAdenineME873931---134.05
HypoxanthineHypoxanthineME874038--8.51135.03
TrigonellineTrigonellineME874160--9.65136.04
6-Hydroxynicotinate6-Hydroxynicotinic acidME873927--8.59138.02
PhosphonoacetatePhosphonoacetic acidME874124--12.74138.98
O-PhosphorylethanolaminePhosphoethanolamineME874111---140.01
N-NitrosoprolineN-NitrosoprolineME874097--9.33143.05
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME873915--7.22144.07
4-Guanidinobutanoic acid4-Guanidinobutanoic acidME873916---144.08
alpha-Ketoglutarate2-Oxoglutaric acidME873940---145.01
L-GlutamineGlutamineME874057--11.77145.06
LysineLysineME874072--16.26145.1
L-GlutamateGlutamic acidME874056--11.76146.05
N-AcetylserineN-AcetylserineME874091--8.04146.05
NMDAN-Methyl-D-aspartic acidME874106--10.86146.05
O-AcetylserineO-AcetylserineME874110--8.38146.05
CitramalateCitramalic acidME873958---147.03
D-alpha-Hydroxyglutaric acid-ME873975--12.51147.03
R 2-HG-ME874135--12.13147.03
MevalonateMevalonic acidME874081--6.81147.07
MethionineMethionineME874078---148.04
TartrateTartaric acidME874147---149.01
GuanineGuanineME874028--9.94150.04
XanthineXanthineME874173--9.32151.03
p-Hydroxyphenylacetic-ME874117--7.62151.04
Cysteinesulfinic acid3-Sulfino-alanineME873971---152
DopamineDopamineME873997--16.2152.07
L-HistidineHistidineME874060--12.89154.06
Orotic acidOrotic acidME874115---155.01
Uracil-5-carboxylateUracil-5-carboxylic acidME874168---155.01
L-DihydroorotateDihydroorotic acidME873896--8.62157.03
AllantoinAllantoinME873938--10.66157.04
Aminoadipic acidAminoadipic acidME873941--11.93160.06
N-methylglutamateN-Methyl-glutamic acidME874096--10.35160.06
L-carnitineCarnitineME874052--10.7160.1
HMGHis-Met-GlyME874032--11.44161.05
5-Hydroxylysine5-HydroxylysineME873921--15.22161.09
N-acetylcysteineN-AcetylcysteineME873897---162.02
2,4-DihydroxypteridineLumazineME873903--7.1163.03
Phenylpyruvic acidPhenylpyruvic acidME874122---163.04
2-Deoxy-D-glucose2-Deoxy-glucoseME873900--11.07163.06
RhamnoseRhamnoseME874137--8.93163.06
PhenylalaninePhenylalanineME874120---164.07
3-Phenyllactic acidPhenyllactic acidME873911---165.06
QuinolinateQuinolinic acidME874134--12.49166.01
Phosphoenol pyruvatePhosphoenolpyruvic acidME874123--13.47166.98
Uric AcidUric acidME874169---167.02
L-Cysteic acidCysteic acidME874053---168
PyridoxinePyridoxineME874131--6.84168.07
3-Methylhistidine3-MethylhistidineME873909---168.08
DHAPDihydroxyacetone phosphateME873993--12.28168.99
Glyceraldehyde 3-phosphateGlyceraldehyde 3-phosphateME874020---168.99
3,4-Dihydroxyphenylglycol3,4-DihydroxyphenylglycolME873913--8.2169.05
Glycerol 3-phosphatesn-Glycero-3-phosphateME874021---171.01
3-Dehydroshikimate3-Dehydroshikimic acidME873906--9.36171.03
Aniline-2-sulfonic acid2-Aminobenzenesulfonic acidME873943--5.01172.01
Phenylalanine-M+8-IS-ME874121---172.12
cis-aconitic ccid-ME873957---173.01
trans-Aconitic acidtrans-Aconitic acidME874158---173.01
Shikimic acidShikimic acidME874144---173.05
N-AcetylasparagineN-AcetylasparagineME874084---173.06
ArginineArginineME873945--16.87173.1
N-acetylaspartateN-Acetylaspartic acidME874085---174.04
Guanidinosuccinic acidGuanidinosuccinic acidME874027--12.2174.05
CitrullineCitrullineME873960--12.25174.09
AscorbateVitamin CME873947---175.02
GlucuronolactoneGlucuronolactoneME874018--8.31175.02
N-Carbamoyl-L-aspartateCarbamoylaspartateME874094---175.04
N-formyl-L-methionineN-FormylmethionineME874095--5.09176.04
S-carboxymethylcysteineS-Carboxymethyl-cysteineME874140--11.64178.02
D-GlucosamineGlucosamineME873977--9.34178.07
Methionine sulfoximineMethionine sulfoximineME874079--11179.05
D-GlucoseGlucoseME873980--11.43179.06
ParaxanthineParaxanthineME874119--4.94179.06
TheobromineTheobromineME874149--4.81179.06
TheophyllineTheophyllineME874150--4.73179.06
L-TyrosineTyrosineME874067---180.07
HexitolSorbitolME874030---181.07
4-Pyridoxic acid4-Pyridoxic acidME873918--2.27182.05
PhosphorylcholineCholine phosphateME874125--11.93182.06
NormetanephrineNormetanephrineME874108--11.37182.08
PhosphoserinePhosphoserineME874126--12.87184
2-Phosphoglyceric acid2-Phosphoglyceric acidME873905---184.99
3-Phosphoglyceric acid3-Phosphoglyceric acidME873914--13.14184.99
N-Alpha-acetyllysineN(2)-AcetyllysineME874093--11.72187.11
TrimethyllysineN-6-TrimethyllysineME874161--15.1187.15
N-acetylglutamateN-Acetylglutamic acidME874086---188.06
Diaminopimelate2,6-Diaminopimelic acidME873994--13.5189.09
CitrateCitric acidME873959--13.35191.02
IsocitrateIsocitric acidME874046--13.99191.02
Quinic acidQuinic acidME874133--9.97191.06
D-GalacturonateGalacturonic acidME873976---193.04
Glucuronic acidGlucuronic acidME874017---193.04
Methyl beta-galactosideMethyl beta-D-galactosideME874080---193.07
GluconateGluconic acidME874015--11.07195.05
Dihydroxybenzoic acidDihydroxybenzoic acidME873996--9.35195.99
L-DopaDOPAME874055--11.94196.06
N,N-DimethylarginineDimethylarginineME874098---201.14
Acetyl-L-carnitineCAR 2:0ME873930--9.37202.11
L-TryptophanTryptophanME874066--9.72203.08
Indole-3-lactic acidIndole-3-lactic acidME874041---204.07
KynurenineKynurenineME874048--9.24207.08
GalactarateGalactaric acidME874007--13.19209.03
SaccharateGlucaric acidME874142--13.08209.03
Creatine PhosphatePhosphocreatineME873965--12.15210.03
3-Methoxytyrosine3-MethoxytyrosineME873907--9.84210.08
2,3-Dideoxycytidine-ME873902---210.09
Indoxyl sulfateIndoxyl sulfateME874042--5.54212
gamma-L-Glutamyl-L-alanine-ME874011--9.12217.08
O-Succinyl-L-homoserineo-SuccinylhomoserineME874112--10.96218.07
Pantothenic acidPantothenic acidME874118--7.05218.1
5-Hydroxytryptophan5-Hydroxy-tryptophanME873922--11.38219.08
GalNAcN-AcetylgalactosamineME874009---220.08
N-AcetylmannosamineN-Acetyl-mannosamineME874088---220.08
CystathionineCystathionineME873970--12.89221.06
3-nitrotyrosineNitrotyrosineME873910--11.23225.05
CarnosineCarnosineME873951--12.09225.1
DeoxycytidineDeoxycytidineME873988---226.08
DeoxyuridineDeoxyuridineME873990--7.27227.07
D-Ribose 5-phosphateRibose 5-phosphateME873983---229.01
CystineCystineME873972--12.58239.02
AnserineAnserineME873944--11.25239.11
ThymidineThymidineME874152--6.47241.08
CytidineCytidineME873973---242.08
UridineUridineME874170--8.39243.06
Isopentenyl pyrophosphateIsopentenyl-diphosphateME874047--10.66245
N-AcetyltryptophanN-Acetyl-tryptophanME874092--6.69245.09
gamma-Glutamylcysteinegamma-GlutamylcysteineME874010---249.06
5'-deoxyadenosine5'-DeoxyadenosineME873926--7.04250.09
DeoxyadenosineDeoxyadenosineME873987--7.4250.09
D-Glucosamine-6-sulfateGlucosamine 6-sulfateME873979--12.51258.03
D-Glucosamine 6-PhosphateGlucosamine 6-phosphateME873978--12.75258.04
Fructose 6-phosphateFructose 6-phosphateME874005---259.02
Galactose-1-phosphateGalactose 1-phosphateME874008---259.02
Glucose 6-phosphateGlucose 6-phosphateME874016--13.07259.02
Hexose-phosphateHexose 6-phosphateME874031---259.02
Mannose-6-phosphateMannose 6-phosphateME874075---259.02
AdenosineAdenosineME873932--7.98266.09
DeoxyguanosineDeoxyguanosineME873989---266.09
HomocystineHomocystineME874035--12.48267.05
InosineInosineME874043--9.2267.07
GlutarylcarnitineCAR DC5:0ME874019--10.56274.13
6-Phospho-D-gluconate6-Phosphogluconic acidME873928---275.02
1-Methyladenosine1-MethyladenosineME873898--7.04280.11
GuanosineGuanosineME874029--10.28282.08
XanthosineXanthosineME874174--9.69283.07
OrotidineOrotidineME874116--10.48287.05
Ophthalmic acidOphthalmic acidME874113--10.77288.12
Sedoheptulose-7-phosphateSedoheptulose 7-phosphateME874143--12.9289.03
Argininosuccinic acidArgininosuccinic acidME873946--13.22289.12
5-Methylthioadenosine5'-MethylthioadenosineME873924--6.81296.08
2',3' Cyclic CMP2',3' cyclic CMPME873904---304.03
dCMPdCMPME873986--11.97306.05
L-Glutathione reducedGlutathioneME874059--11.93306.08
dUMPdUMPME873999--11.13307.03
N-AcetylneuraminateN-Acetylneuraminic acidME874089--10.78308.1
FGARFGARME874002--12.25313.04
TMPTMPME874155---321.05
CMPCMPME873961---322.04
UMPUMPME874166--12.23323.03
Cyclic AMP3',5' cyclic AMPME873969--7.93328.05
dAMPdAMPME873984--10.72330.06
NMNNicotinamide ribotideME874107--12.57333.05
AICARAICARME873937--12.15337.06
Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME874004--14.07338.99
LactoseLactoseME874070--12.37341.11
TrehaloseTrehaloseME874159--12.3341.11
LauroylcarnitineCAR 12:0ME874071--6.76342.26
Thiamine monophosphateThiamine monophosphateME874151---343.06
cGMP3',5' cyclic GMPME873955---344.04
AMPAMPME873942--11.51346.06
dGMPdGMPME873991---346.06
IMPIMPME874040--12.4347.04
Thyrotropin-releasing hormoneThyrotropin releasing hormoneME874154--8.36361.16
GMPGMPME874024--13.09362.05
XMPXMPME874175--13.69363.03
RiboflavinRiboflavinME874138---375.13
S-Adenosyl-L-homocysteineS-AdenosylhomocysteineME874139---383.11
dCDPdCDPME873985--12.68386.02
PRPPPhosphoribosyl pyrophosphateME874129--14.15388.94
S-HexylglutathioneS-Hexyl-glutathioneME874141--7.24390.17
CDPCDPME873952--13.16402.01
UDPUDPME874162--12.88402.99
Adenosine 3',5'-diphosphateAdenosine 3',5'-diphosphateME873933--12.91426.02
ADPADPME873936--12.32426.02
Inosine-5'-diphosphateIDPME874045--13.01427.01
CMP-2-aminoethylphosphonateCMPciliatineME873962--12.16429.06
Folic acidFolic acidME874003--13.03440.13
GDPGDPME874012--13.72442.02
Dihydrofolic acidDihydrofolic acidME873995--12.64442.15
CDP-ethanolamineCDP-EthanolamineME873954---445.05
dUTPdUTPME874000--13.02466.97
CTPCTPME873967--13.85481.98
UTPUTPME874172--13.7482.96
CDP-cholineCDP-cholineME873953--12.12487.1
RaffinoseRaffinoseME874136--12.72503.16
ATPATPME873949--13.06505.99
dGTPdGTPME873992--13.72505.99
Inosine triphosphateITPME874044--13.7506.97
GTPGTPME874025--14.34521.98
Cyclic ADP-riboseCyclic ADP-riboseME873968--11.55540.05
Adenosine 5'-diphosphoriboseADP-riboseME873934--11.95558.06
dTDP-D-glucosedTDP-glucoseME873998--11.65563.07
UDP-glucoseUDP-glucoseME874164---565.05
Uridine 5'-diphosphogalactoseUDP-galactoseME874171--12.87565.05
Adenosine-5'-diphosphoglucoseADP-glucoseME873935--11.97588.07
GDP-fucoseGDP-L-fucoseME874014--13.5588.07
GDP-alpha-D-mannoseGDP-mannoseME874013--13.87604.07
UDP-GalNAcUDP-N-acetylgalactosamineME874163--12.13606.07
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME874165--12.1606.07
L-Glutathione oxidizedGlutathioneME874058---611.14
Meso-tartrateMeso-tartaric acidME874076--12.72657.73
Phytic acidInositol hexakisphosphateME874127--15.23658.85
NADNADME874099--11.63662.1
NHDAsn-His-AspME874103--12.27663.09
NADHNADHME874100---664.12
StachyoseStachyoseME874145---665.21
Glyoxylic acidGlyoxylic acidME874023--12.9272.99
GlycineGlycineME874022--7.674.02
NADPNADPME874101--13.03742.07
NADPHNADPHME874102--12.84744.08
Coenzyme ACoenzyme AME873963--11.8766.11
FADFADME874001---784.15
Acetyl-CoAAcetyl-CoAME873929---808.12
3-methylcrotonyl-CoA3-Methylbut-2-enoyl-CoAME873908--9.54848.15
PyruvatePyruvic acidME874132---87.01
L-AlanineAlanineME874049--11.4788.04
LactateLactic acidME874069---89.02
HMG-CoA3-Hydroxy-3-methylglutaryl-CoAME874033--12.16910.15


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