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Analysis: CE POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,3-Diaminopropane1,3-DiaminopropaneME590467---75.0934
1-Amino-1-cyclopentanecarboxylate1-Azaniumylcyclopentane-1-carboxylateME590461---130.0873
1-Aminocyclopropane-1-carboxylate1-Aminocyclopropanecarboxylic acidME590462---102.0567
1-Methyl-2-pyrrolidinoneN-Methylpyrrolidin-2-oneME590463---100.0774
1-Methyladenosine1-MethyladenosineME590464---282.1227
1-Methylhistamine1-MethylhistamineME590465---126.1041
1-Methylnicotinamide1-Methyl nicotinamideME590466---137.0726
2,3-Diaminopropionate2,3-Diaminopropionic acidME590468---105.0674
2,4-Diaminobutyrate2,4-Diaminobutyric acidME590469---119.0825
2,4-Dimethylaniline2,4-DimethylanilineME590470---122.0982
2AB2S-Aminobutyric acidME590471---104.0719
2-Aminobenzimidazole-ME590472---134.0731
2-Aminophenol2-AminophenolME590473---110.0624
2'-DeoxycytidineDeoxycytidineME590474---228.1008
2'-DeoxyguanosineDeoxyguanosineME590475---268.1074
2'-DeoxyinosineDeoxyinosineME590476---253.0974
2-Deoxystreptamine2-DeoxystreptamineME590477---163.1100
2-Guanidinobenzimidazole2-GuanidinobenzimidazoleME590478---176.0954
3,3',5-TriiodothyronineLiothyronineME590479---651.7991
3,5-Diiodo-tyrosine3,5-Diiodo-L-tyrosineME590480---433.8777
3-Aminoisobutyrate3-Aminoisobutanoic acidME590481---104.0722
3-Aminopropane-1,2-diol(S)-3-Amino-1,2-propanediolME590482---92.0724
3-Aminopropionitrile-ME590483---71.0622
3-Chloroalanine-ME590484---124.0177
3-Hydroxyanthranilate3-Hydroxyanthranilic acidME590485---154.0514
3-HydroxykynurenineHydroxykynurenineME590486---225.0897
3-IodotyrosineIodotyrosineME590487---307.9801
3-Methoxytyramine3-MethoxytyramineME590488---168.1043
3-Methyladenine3-MethyladenineME590489---150.0791
3-Methylguanine3-MethylguanineME590490---166.0747
3-Methylhistidine3-MethylhistidineME590491---170.0941
4-Amino-3-hydroxybutyrate-ME590493---120.0676
4-AminosalicylateAminosalicylic acidME590494---154.0518
4-(beta-Acetylaminoethyl)imidazoleN-AcetylhistamineME590492---154.0997
4-HydroxymethylimidazoleImidazole-4-methanolME590495---99.0572
4-Methyl-5-thiazoleethanol5-(2-Hydroxyethyl)-4-methylthiazoleME590496---144.0498
5,6-DimethylbenzimidazoleDimethylbenzimidazoleME590497---147.0933
5-Aminolevulinate5-Amino-levulinic acidME590498---132.0673
5-Aminovalerate5-Aminopentanoic acidME590499---118.0883
5'-Deoxyadenosine5'-DeoxyadenosineME590500---252.1128
5-Hydroxyindoleacetate5-Hydroxyindoleacetic acidME590501---192.0684
5-Hydroxylysine5-HydroxylysineME590502---163.1099
5-Hydroxytryptophan5-Hydroxy-tryptophanME590503---221.0944
5-Methoxyindoleacetate5-Methoxyindoleacetic acidME590504---206.0853
5-Methoxytryptamine5-MethoxytryptamineME590505---191.1203
5-Methyl-2'-deoxycytidine5-Methyl-2'-deoxycytidineME590506---242.1161
5-Methylcytosine5-MethylcytosineME590507---126.0664
5-Methyltetrahydrofolate5-Methyltetrahydrofolic acidME590508---460.1977
5-Methylthioadenosine5'-MethylthioadenosineME590509---298.1001
5-OxoprolinePyroglutamic acidME590510---128.0360
6-AminohexanoateAminocaproic acidME590511---132.1032
6-Hydroxynicotinate6-Hydroxynicotinic acidME590512---140.0350
6-Methylaminopurine-ME590513---150.0791
7,8-Dihydrobiopterin-ME590514---240.1121
7,8-Dihydroneopterin7,8-DihydroneopterinME590515---256.1068
7-Methylguanine7-MethylguanineME590516---166.0742
AcetylcholineAcetylcholineME590241---146.1187
AdenineAdenineME590242---136.0635
AdenosineAdenosineME590243---268.1073
ADMADimethylarginineME590244---203.1511
AgmatineAgmatineME590245---131.1307
AICARAICA ribonucleotideME590246---339.0728
AlaAlanineME590247---90.0566
Ala-AlaAla-AlaME590248---161.0939
AllantoinAllantoinME590249---159.0606
AlliinAlliinME590250---178.0549
alpha-AminoadipateAminoadipic acidME590251---162.0779
alpha-Methylbenzylamine-ME590252---122.0981
Alpha-MethylserineAlpha-MethylserineME590253---120.0670
Amantadine-ME590254---152.1453
AnilineAnilineME590255---94.0669
AnserineAnserineME590256---121.0706
Anthranilate2-Aminobenzoic acidME590257---138.0567
ArgArginineME590258---175.1215
Arginine ethyl esterEthyl arginateME590259---203.1529
ArgininosuccinateArgininosuccinic acidME590260---291.1327
AsnAsparagineME590261---133.0623
AspAspartic acidME590262---134.0470
BenzamideBenzamideME590263---122.0604
BenzamidineBenzamidineME590264---121.0776
Benzimidazole1H-BenzimidazoleME590265---119.0618
beta-Alabeta-AlanineME590266---90.0561
beta-Ala-Lys-ME590267---109.5810
beta-CyanoalanineCyanoalanineME590268---115.0516
beta-ImidazolelactateImidazolelactic acidME590269---157.0625
BetaineBetaineME590270---118.0876
Betaine aldehydeBetaineME590271---102.0919
beta-Leucinebeta-LeucineME590272---132.1033
BetonicineBetonicineME590273---160.0975
Bis(3-aminopropyl)amineNorspermidineME590274---132.1514
CadaverineCadaverineME590275---103.1246
CanavanineCanavanineME590276---177.1007
CarnitineCarnitineME590277---162.1140
CarnosineCarnosineME590278---114.0623
CastanospermineCastanospermineME590279---190.1072
CholineCholineME590280---104.1088
CitrullineCitrullineME590281---176.1055
CreatineCreatineME590282---132.0788
CreatinineCreatinineME590283---114.0677
CyanocobalaminCyanocobalaminME590284---678.2963
CyclohexylamineCyclohexylamineME590285---100.1131
CysCysteineME590286---122.0282
Cys-GlyCys-GlyME590287---179.0505
CystathionineCystathionineME590288---223.0781
CysteamineCysteamineME590289---78.0389
Cysteine-glutathione disulphide-ME590290---214.0544
CystineCystineME590291---241.0334
CytidineCytidineME590292---244.0965
CytosineCytosineME590293---112.0515
DesthiobiotinDethiobiotinME590294---215.1409
DiethanolamineDiethanolamineME590295---106.0875
DihydrouracilDihydrouracilME590296---115.0502
DOPADOPAME590297---198.0776
DopamineDopamineME590298---154.0879
EctoineEctoineME590299---143.0814
EpinephrineEpinephrineME590300---184.0988
Ethanolamine phosphatePhosphoethanolamineME590301---140.0127
GABAgamma-Aminobutyric acidME590302---104.0718
gamma-Butyrobetaine3-DehydroxycarnitineME590303---146.1195
gamma-Glu-2ABgamma-Glutamyl-2-aminobutanoateME590304---233.1165
gamma-Glu-cysgamma-GlutamylcysteineME590305---251.0723
gamma-Guanidinobutyrate4-Guanidinobutanoic acidME590306---146.0904
GlnGlutamineME590307---147.0788
GluGlutamic acidME590308---148.0648
GlucosaminateGlucosaminic acidME590309---196.0841
GlucosamineGlucosamineME590310---180.0883
Glu-GluGlu-GluME590311---277.1059
Glutathione(ox)Oxidized glutathioneME590312---307.0873
Glutathione(red)GlutathioneME590313---308.0943
GlyGlycineME590314---76.0412
Glycerophosphorylcholinesn-Glycero-3-phosphocholineME590315---258.1127
Gly-GlyGly-GlyME590316---133.0614
Gly-LeuGly-LeuME590317---189.1276
Gramine-ME590318---175.1251
GuanidinoacetateGuanidoacetic acidME590319---118.0628
GuanidinosuccinateGuanidinosuccinic acidME590320---176.0680
GuanineGuanineME590321---152.0588
GuanosineGuanosineME590322---284.1019
HarmanHarmanME590323---183.0943
HexylamineHexylamineME590324---102.1294
HisHistidineME590325---156.0788
HistamineHistamineME590326---112.0883
HistidinolL-HistidinolME590327---142.0990
HomocarnosineHomocarnosineME590328---121.0708
HomocysteineHomocysteineME590329---136.0443
HomocystineDL-HomocystineME590330---269.0664
HomoserineHomoserineME590331---120.0681
HydroxyprolineHydroxyprolineME590332---132.0665
HydroxyureaHydroxyureaME590333---77.0366
HypotaurineHypotaurineME590334---110.0285
HypoxanthineHypoxanthineME590335---137.0476
Ibotenate-ME590336---159.0421
IleIsoleucineME590337---132.1035
Imidazole-4-acetateImidazoleacetic acidME590338---127.0516
Indole-3-acetaldehydeIndoleacetaldehydeME590339---160.0618
Indole-3-acetamide1H-Indole-3-acetamideME590340---175.0888
Indole-3-acetateIndoleacetic acidME590341---176.0709
Indole-3-ethanolTryptophanolME590342---162.0993
InosineInosineME590343---269.0911
Isoamylamine3-Methyl-1-butylamineME590344---88.1134
Isobutylamine-ME590345---74.0984
Isonicotinamide-ME590346---123.0565
IsopropanolamineIsopropanolamineME590347---76.0771
KynurenineKynurenineME590348---209.0943
LeuLeucineME590349---132.1037
Leu-Leu-TyrLeu-Leu-TyrME590350---408.2529
LysLysineME590351---147.1156
LysinamideLysinamideME590352---146.1271
Mannosamine2-Amino-2-deoxy-D-mannoseME590353---180.0892
MelamineMelamineME590354---127.0745
MelatoninMelatoninME590355---233.1310
MetMethionineME590356---150.0602
MetforminMetforminME590357---130.1107
Methionine sulfoxideMethionine sulfoxideME590358---166.0544
Methionine sulfoximineMethionine sulfoximineME590359---181.0662
MethylguanidineMethylguanidineME590360---74.0733
MuramateMuramic acidME590361---252.1106
Muscimol-ME590362---115.0517
N1-AcetylspermidineN1-AcetylspermidineME590366---188.1780
N1-AcetylspermineN1-AcetylspermineME590367---123.1227
N1,N12-DiacetylspermineN1,N12-DiacetylspermineME590364---144.1283
N1,N8-DiacetylspermidineN1,N8-DiacetylspermidineME590365---230.1892
N6-Methyl-2'-deoxyadenosineN6-Methyl-2'-deoxyadenosineME590369---266.1287
N6,N6,N6-TrimethyllysineN-6-TrimethyllysineME590368---189.1609
N8-AcetylspermidineN8-AcetylspermidineME590370---188.1781
N-AcetylglucosamineN-Acetyl-D-glucosamineME590371---222.0997
N-AcetylglucosylamineN-Acetyl-beta-glucosaminylamineME590372---221.1141
N-AcetylhistidineN-AcetylhistidineME590373---198.0895
N-AcetylornithineN-AcetylornithineME590374---175.1099
N-AcetylputrescineN-AcetylputrescineME590375---131.1197
N-AcetylvalineN-AcetylvalineME590376---160.0989
N-alpha-Benzenolarginine ethylesterBz-Arg-OEtME590378---307.1800
N-alpha,N-alpha-DimethylhistidineN,N-DimethylhistidineME590377---184.1105
n-Butyl a-Picolinate-ME590379---180.1041
N-epsilon-AcetyllysineN6-AcetyllysineME590380---189.1252
N-gamma-EthylglutamineN(5)-Ethyl-glutamineME590381---175.1101
NicotinamideNiacinamideME590382---123.0564
NicotineNicotineME590383---163.1250
N-MethylalanineN-MethylalanineME590384---104.0720
N-MethylanilineN-MethylanilineME590385---108.0826
N-MethylglutamateN-Methyl-glutamic acidME590386---162.0759
NMNNicotinamide ribotideME590387---335.0671
N,N-DimethylglycineDimethylglycineME590363---104.0717
N-omega-MethyltryptamineN-MethyltryptamineME590388---175.1251
NoradrenalineXi-NorepinephrineME590389---170.0834
NornicotineNornicotineME590390---149.1089
o-AcetylcarnitineCAR 2:0ME590391---204.1255
O-AcetylserineO-AcetylserineME590392---148.0623
OctopineOctopineME590393---247.1430
OctylamineOctylamineME590394---130.1610
OphthalmateOphthalmic acidME590395---290.1379
OrnithineOrnithineME590396---133.0987
o-Succinylhomoserineo-SuccinylhomoserineME590397---220.0846
p-AminobenzoateP-Aminobenzoic acidME590398---138.0571
PhePhenylalanineME590399---166.0883
PhenethylaminePhenylethylamineME590400---122.0982
Phenylethanolamine2-HydroxyphenethylamineME590401---138.0932
Phe-PhePhe-PheME590402---313.1573
PhosphorylcholineCholine phosphateME590403---184.0759
PicolinamidePicolinamideME590404---123.0565
PipecolatePipecolic acidME590405---130.0876
ProProlineME590406---116.0720
Proline betaineProline betaineME590407---144.1035
Pseudopelletierinepsi-PelletierineME590408---154.1250
PterinPterinME590409---164.0590
PurinePurineME590410---121.0526
Purine ribosideNebularineME590411---253.0960
Putrescine(1,4-Butanediamine)PutrescineME590412---89.1090
Pyrazole1H-pyrazoleME590413---69.0460
PyridoxalPyridoxalME590414---168.0658
PyridoxaminePyridoxamineME590415---169.0992
Pyridoxamine 5'-phosphatePyridoxamine 5'-phosphateME590416---249.0648
PyridoxinePyridoxineME590417---170.0835
RiboflavinRiboflavinME590418---377.1324
SaccharopineSaccharopineME590419---277.1433
SAHS-AdenosylhomocysteineME590420---193.0707
SAM+S-AdenosylmethionineME590421---200.0793
SarcosineSarcosineME590422---90.0561
SDMASymmetric dimethylarginineME590423---203.1523
SepiapterinSepiapterinME590424---238.0961
SerSerineME590425---106.0517
SerotoninSerotoninME590426---177.1043
S-LactoylglutathioneS-LactoylglutathioneME590427---380.1153
S-MethylmethionineS-MethylmethionineME590428---164.0749
SpermidineSpermidineME590429---146.1666
SpermineSpermineME590430---102.1177
SynephrineSynephrineME590431---168.1046
TaurineTaurineME590432---126.0233
TaurocyamineTaurocyamineME590433---168.0483
TetrahydropalmatineTetrahydropalmatineME590434---356.1893
ThiamineThiamineME590435---265.1144
Thiamine monophosphateThiamine monophosphateME590436---345.0806
ThrThreonineME590437---120.0676
ThymidineThymidineME590438---243.0994
ThymineThymineME590439---127.0417
trans-Zeatintrans-ZeatinME590440---220.1221
TRHThyrotropin releasing hormoneME590441---363.1812
Trientine-ME590442---147.1621
TrigonellineTrigonellineME590443---138.0568
TrimethylamineTrimethylamineME590444---60.0828
Trimethylamine N-oxideTrimethylamine N-oxideME590445---76.0770
TrimethylsulfoniumTrimethyl sulfoniumME590446---77.0440
TropinePseudotropineME590447---142.1248
TropinoneTropinoneME590448---140.1081
TrpTryptophanME590449---205.0998
TryptamineTryptamineME590450---161.1096
TyrTyrosineME590451---182.0836
TyramineTyramineME590452---138.0934
UracilUracilME590453---113.0376
UreaUreaME590454---61.0418
UridineUridineME590455---245.0857
UrocanateUrocanic acidME590456---139.0522
ValValineME590457---118.0877
XanthineXanthineME590458---153.0421
XanthopterinXanthopterinME590459---180.0538
XanthosineXanthosineME590460---285.0859


Analysis: CE NEGATIVE 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 acidME590752---187.1355
1-Aminoethylphosphonate-ME590701---124.0180
2',3'-cCMP2',3' cyclic CMPME590702---304.0367
2,3-DPG2,3-Diphosphoglyceric acidME590703---264.9544
2,3-PyridinedicarboxylateQuinolinic acidME590704---166.0171
2,4-Dihydroxypyrimidine-5-carboxylateUracil-5-carboxylic acidME590705---155.0112
2,5-DihydroxybenzoateGentisic acidME590706---153.0207
2-Amino-3-phosphonopropionate-ME590707---168.0082
2-AminoethylphosphonateCiliatineME590708---124.0179
2-Deoxyglucose 6-phosphate2-Deoxy-D-glucose 6-phosphateME590709---243.0294
2-Deoxyribose 1-phosphateDeoxyribose 1-phosphateME590710---213.0198
2-Furoate2-Furoic acidME590711---111.0094
2-Hydroxy-4-methylpentanoateD-Leucic acidME590712---131.0717
2-Hydroxybutyrate2-Hydroxybutyric acidME590713---103.0409
2-Hydroxyglutarate2-Hydroxyglutaric acidME590714---147.0313
2-Hydroxyisobutyrate2-Hydroxyisobutyric acidME590715---103.0407
2-Hydroxyoctanoate2-Hydroxyoctanoic acidME590716---159.1036
2-Hydroxypentanoate2-Hydroxyvaleric acidME590717---117.0560
2-Hydroxyphenylacetate2-Hydroxyphenylacetic acidME590718---151.0418
2-Isopropylmalate2-Isopropylmalic acidME590719---175.0626
2-OxoadipateOxoadipic acidME590720---159.0306
2-Oxobutyrate3-Methyl pyruvic acidME590721---101.0249
2-OxoglutarateOxoglutaric acidME590722---145.0155
2-OxoisopentanoateKetoisovaleric acidME590723---115.0407
2-Oxooctanoate-ME590724---157.0882
2PG2-Phosphoglyceric acidME590725---184.9877
2-QuinolinecarboxylateQuinaldic acidME590726---172.0416
2-Thiopheneacetate2-Thienylacetic acidME590727---141.0024
3-(2-Hydroxyphenyl)propionate3-(2-Hydroxyphenyl)propanoic acidME590728---165.0573
3-(4-Hydroxyphenyl)propionateDesaminotyrosineME590729---165.0573
3',5'-Cyclic dAMP-ME590730---312.0532
3'-AMP3'-AMPME590731---346.0587
3-Hydroxy-3-methylglutarate3-Hydroxymethylglutaric acidME590732---161.0473
3-Hydroxybutyrate3-Hydroxybutyric acidME590733---103.0407
3-HydroxypropionateHydroxypropionic acidME590734---89.0251
3-Indolebutyrate3-Indolebutyric acidME590735---202.0889
3-Indoxyl sulfateIndoxyl sulfateME590736---212.0041
3-MethylbutanoateIsovaleric acidME590737---101.0613
3PG3-Phosphoglyceric acidME590738---184.9874
3-PhenyllactatePhenyllactic acidME590739---165.0561
3-PhenylpropionateHydrocinnamic acidME590740---149.0614
3-UreidopropionateUreidopropionic acidME590741---131.0467
4-Acetylbutyrate5-Ketocaproic acidME590742---129.0564
4-Hydroxy-3-methoxymandelateVanillylmandelic acidME590743---197.0474
4-Hydroxymandelate4-Hydroxymandelic acidME590744---167.0366
4-Methyl-2-oxopentanoateKetoleucineME590745---129.0566
4-Methylthio-2-oxobutyrate2-Oxo-4-methylthiobutanoic acidME590746---147.0136
4-Oxohexanoate-ME590747---129.0567
4-OxopentanoateLevulinic acidME590748---115.0404
4-Pyridoxate4-Pyridoxic acidME590749---182.0485
6-Hydroxyhexanoate6-Hydroxycaproic acidME590750---131.0719
6-Phosphogluconate6-Phosphogluconic acidME590751---275.0200
Acetyl CoAAcetyl-CoAME590517---403.5591
Adenosine 3',5'-diphosphateAdenosine 3',5'-diphosphateME590518---426.0243
Adenosine 5'-phosphosulfateAdenosine phosphosulfateME590519---426.0155
AdenylosuccinateAdenylsuccinic acidME590520---462.0698
AdipateAdipic acidME590521---145.0521
ADPAdenosineME590522---426.0250
ADP-glucoseADP-glucoseME590523---588.0821
ADP-riboseADP-riboseME590524---558.0657
AllantoateAllantoic acidME590525---175.0485
AMPAMPME590526---346.0587
ATPATPME590527---505.9918
AzelateAzelaic acidME590528---187.0992
BarbiturateBarbituric acidME590529---127.0155
BenzoateBenzoic acidME590530---121.0304
BenzoylformatePhenylglyoxylic acidME590531---149.0258
Benzylsuccinate(R)-2-Benzylsuccinic acidME590532---207.0680
BiotinBiotinME590533---243.0831
ButyrateButyric acidME590534---87.0453
cAMP3',5' cyclic AMPME590535---328.0480
CarbamoylaspartateCarbamoylaspartateME590536---175.0372
CarbamoylphosphateCarbamoylphosphateME590537---139.9762
CDPCDPME590538---402.0136
CDP-cholineCytidine 5'-diphosphocholineME590539---547.1242
cGMP3',5' cyclic GMPME590540---344.0432
CholateCholic acidME590541---407.2835
cIMP-ME590542---329.0318
cis-Aconitatecis-Aconitic acidME590543---173.0107
CitraconateCitraconic acidME590544---129.0207
CitramalateCitramalic acidME590545---147.0317
CitrateCitric acidME590546---191.0214
CMPCMPME590547---322.0473
CMP-N-acetylneuraminate-ME590548---613.1423
CoACoenzyme AME590549---382.5537
CrotonateCrotonic acidME590550---85.0301
CTPCTPME590551---481.9802
CysteateCysteic acidME590552---167.9989
Cysteine S-sulfateCysteine-S-sulfateME590553---199.9712
Cysteine sulfinate3-Sulfino-alanineME590554---152.0041
dADPdADPME590555---410.0301
dAMPdAMPME590556---330.0633
dATPdATPME590557---489.9962
DCADeoxycholic acidME590558---391.2881
dCDPdCDPME590559---386.0190
dCMPdCMPME590560---306.0530
dCTPdCTPME590561---465.9853
Deamido-NAD+-ME590562---663.0865
DecanoateCapric acidME590563---171.1398
dGTPdGTPME590564---505.9912
DHAPDihydroxyacetone phosphateME590565---168.9932
DigalacturonateDigalacturonic acidME590566---369.0701
Dihydroorotate4,5-Dihydroorotic acidME590567---157.0264
dITPdITPME590568---490.9803
DodecanedioateDodecanedioic acidME590569---229.1464
DodecanoateLauric acidME590570---199.1721
dTDPdTDPME590571---401.0172
dTMPdTMPME590572---321.0516
dTTPdTTPME590573---480.9850
dUDPdUDPME590574---387.0030
dUMPdUMPME590575---307.0361
dUTPdUTPME590576---466.9693
F1,6PFructose 1,6-bisphosphateME590577---338.9916
F6PFructose 6-phosphateME590578---259.0250
FADFADME590579---784.1499
FolateFolic acidME590580---440.1349
FumarateFumaric acidME590581---115.0047
G1PGlucose 1-phosphateME590582---259.0257
G3PGlyceraldehyde 3-phosphateME590583---168.9919
G6PGlucose 6-phosphateME590584---259.0250
Galacturonate 1-phosphate-ME590585---273.0043
GDPGDPME590586---442.0201
GDP-mannoseGDP-mannoseME590587---604.0718
GluconateGluconic acidME590588---195.0529
Glucosamine 6-phosphateGlucosamine 6-phosphateME590589---258.0410
GlucuronateGlucuronic acidME590590---193.0377
GlutarateGlutaric acidME590591---131.0362
GlycerateGlyceric acidME590592---105.0204
Glycerophosphatesn-Glycero-3-phosphateME590593---171.0081
GlycocholateGlycocholic acidME590594---464.3038
GlycolateGlycolic acidME590595---75.0096
GlyoxylateGlyoxylic acidME590596---72.9940
GMPGMPME590597---362.0532
GTPGTPME590598---521.9863
HeptanoateHeptylic acidME590599---129.0926
HexanoateCaproic acidME590600---115.0771
HippurateHippuric acidME590601---178.0534
HomovanillateHomovanillic acidME590602---181.0521
IDPIDPME590603---427.0091
IMPIMPME590604---347.0419
IndolelactateIndolelactic acidME590605---204.0686
Isethionate2-HydroxyethanesulfonateME590606---124.9923
Isobutyryl CoAIsobutyryl-CoAME590607---417.5747
IsocitrateIsocitric acidME590608---191.0213
ItaconateItaconic acidME590609---129.0204
ITPITPME590610---506.9752
LactateLactic acidME590611---89.0252
MalateD-Malic acidME590612---133.0152
MalonateMalonic acidME590613---103.0044
Malonyl CoAMalonyl-CoAME590614---425.5540
MethanesulfonateMethanesulfonic acidME590615---94.9823
Methyl sulfateMethyl sulfateME590616---110.9770
(Methylthio)acetate(Methylthio)acetic acidME590617---105.0028
m-Hydroxybenzoate3-Hydroxybenzoic acidME590618---137.0255
MucateGalactaric acidME590619---209.0321
N-AcetylaspartateN-Acetylaspartic acidME590620---174.0426
N-Acetyl-beta-alanineN-Acetyl-beta-alanineME590621---130.0520
N-Acetylglucosamine 1-phosphateN-Acetyl-D-glucosamine 1-phosphateME590622---300.0519
N-Acetylglucosamine 6-phosphateN-Acetyl-glucosamine 6-phosphateME590623---300.0519
N-AcetylglutamateN-Acetylglutamic acidME590624---188.0582
N-AcetylleucineN-AcetylleucineME590625---172.0989
N-AcetylmethionineN-AcetylmethionineME590626---190.0559
N-AcetylmuramateN-Acetylmuramic acidME590627---292.1061
N-AcetylneuraminateN-Acetylneuraminic acidME590628---308.1017
N-AcetylphenylalanineN-AcetylphenylalanineME590629---206.0835
NAD+NAD+ME590630---662.1037
NADHNADHME590631---664.1185
NADP+NADP+ME590632---742.0693
NADPHNADPHME590633---371.5417
N-CarbamylglutamateCarglumic acidME590634---189.0537
N-FormylaspartateN-Formyl-aspartic acidME590635---160.0263
N-FormylmethionineN-FormylmethionineME590636---176.0389
NicotinateNicotinic acidME590637---122.0263
o-Coumaratetrans-o-Coumaric acidME590638---163.0414
OctanoateCaprylic acidME590639---143.1087
o-HydroxybenzoateSalicylic acidME590640---137.0258
o-HydroxyhippurateSalicyluric acidME590641---194.0476
O-PhosphoserineDL-O-PhosphoserineME590642---184.0038
OrotateOrotic acidME590643---155.0115
Orotidine 5'-monophosphateOrotidylic acidME590644---367.0214
P1, P4-Di(adenosine-5') tetraphosphate-ME590645---417.0204
PantothenatePantothenic acidME590646---218.1053
p-Coumaratecis-p-Coumaric acidME590647---163.0413
PelargonatePelargonic acidME590648---157.1235
PentanoateValeric acidME590649---101.0613
PEPPhosphoenolpyruvic acidME590650---166.9764
PhenaceturatePhenylacetylglycineME590651---192.0676
Phenyl phosphatePhenyl phosphateME590652---173.0025
PhenylpyruvatePhenylpyruvic acidME590653---163.0421
PhosphonoacetatePhosphonoacetateME590654---138.9810
PhthalatePhthalic acidME590655---165.0216
p-Hydroxybenzoate4-Hydroxybenzoic acidME590656---137.0257
p-Hydroxyphenylacetate4-Hydroxyphenylacetic acidME590657---151.0420
PimelatePimelic acidME590658---159.0678
PorphobilinogenPorphobilinogenME590659---225.0901
PropionatePropionic acidME590660---73.0304
Prostaglandin E2PGE2ME590661---351.2205
Prostaglandin F2alphaPGF2alphaME590662---353.2361
PRPPPhosphoribosyl pyrophosphateME590663---388.9474
Pyrrole-2-carboxylatePyrrole-2-carboxylic acidME590664---110.0255
PyruvatePyruvic acidME590665---87.0095
QuinateQuinic acidME590666---191.0573
R5PRibose 5-phosphateME590667---229.0138
Ribulose 1,5-diphosphateRibulose 1,5-bisphosphateME590668---308.9809
Ru5PRibulose 5-phosphateME590669---229.0138
S7PSedoheptulose 7-phosphateME590670---289.0351
SaccharateGlucaric acidME590671---209.0326
SebacateSebacic acidME590672---201.1153
Serine O-sulfateSerine-O-sulfateME590673---183.9937
ShikimateShikimic acidME590674---173.0474
SinapateSinapic acidME590675---223.0633
Sorbitol 6-phosphate-ME590676---261.0362
SuccinateSuccinic acidME590677---117.0202
Succinyl CoASuccinyl-CoAME590678---432.5615
SyringateSyringic acidME590679---197.0474
TartrateTartaric acidME590680---149.0103
TaurocholateTaurocholic acidME590681---514.2869
TDP-glucosedTDP-glucoseME590682---563.0712
TerephthalateTerephthalic acidME590683---165.0216
ThreonateThreonic acidME590684---135.0310
TiglateTiglic acidME590685---99.0459
trans-4-Hydroxy-3-methoxycinnamatetrans-Ferulic acidME590686---193.0515
trans-Aconitatetrans-Aconitic acidME590687---173.0106
trans-Cinnamatetrans-Cinnamic acidME590688---147.0462
Trehalose 6-phosphateTrehalose 6-phosphateME590689---421.0827
UDPUDPME590690---402.9977
UDP-glucoseUDP-glucoseME590691---565.0504
UDP-glucuronateUDP-glucuronic acidME590692---579.0289
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME590693---606.0763
UMPUMPME590694---323.0308
UndecanoateUndecylic acidME590695---185.1558
UrateUric acidME590696---167.0225
UTPUTPME590697---482.9641
XanthurenateXanthurenic acidME590698---204.0322
XMPXMPME590699---363.0371
XTPXanthosine 5-triphosphateME590700---522.9700


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