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Analysis: HILIC POSITIVE 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
1H-Indole-3-acetamide1H-Indole-3-acetamideME606194---175.08614
1H-Indole-3-carboxaldehyde1H-Indole-3-carboxaldehydeME606195---146.05977
1-Methyladenosine1-MethyladenosineME606087---282.11902
1-Methylguanosine1-MethylguanosineME606089---298.11429
1-Methylhistamine1-MethylhistamineME606090---126.10233
1-Methyl nicotinamide1-Methyl nicotinamideME606091---137.07071
2-Amino-2-deoxy-D-mannose2-Amino-2-deoxy-D-mannoseME606205---180.08624
2-Aminocaprylic acid2-Aminocaprylic acidME606113---160.13268
3-Dehydroxycarnitine3-DehydroxycarnitineME606169---146.1172
3-Methylcrotonylglycine3-MethylcrotonylglycineME606118---158.08107
3-Methylcytidine3-MethylcytidineME606119---258.10837
3-Methylhistidine3-MethylhistidineME606120---170.09201
4-Guanidinobutanoic acid4-Guanidinobutanoic acidME606123---146.09203
4-Hydroxyquinoline4-HydroxyquinolineME606124---146.05956
4-Pyridoxic acid4-Pyridoxic acidME606126---184.05952
5,8,11-Eicosatriynoic acid5,8,11-Eicosatriynoic acidME606129---301.21576
5-Hydroxyindole5-HydroxyindoleME606131---134.05971
5-Methylcytidine5-MethylcytidineME606133---258.10892
5-Methylcytosine5-MethylcytosineME606132---126.06593
5'-Methylthioadenosine5'-MethylthioadenosineME606128---298.09595
7,8-Dihydrobiopterin7,8-DihydrobiopterinME606136---240.10715
AcetylcholineAcetylcholineME606140---146.11708
AdenosineAdenosineME606141---268.10345
AlanineAlanineME606142---90.05508
alpha-Iononealpha-IononeME606292---193.15817
Aminoadipic acidAminoadipic acidME606137---162.07574
AMPAMPME606138---348.06973
AnserineAnserineME606143---241.12898
ArginineArginineME606145---175.1183
Argininosuccinic acidArgininosuccinic acidME606147---291.12601
AsparagineAsparagineME606150---133.0686
Asp-ArgAsp-ArgME606148---290.14502
Aspartic acidAspartic acidME606151---134.04456
Asp-HisAsp-HisME606149---271.10309
BetaineBetaineME606152---118.08592
Betaine aldehyde cationBetaineME606153---120.10168
BiliverdinBiliverdinME606154---583.25507
CAR 10:0CAR 10:0ME606171---316.24744
CAR 12:0CAR 12:0ME606298---344.27847
CAR 14:0CAR 14:0ME606210---372.30948
CAR 16:0CAR 16:0ME606248---400.34106
CAR 16:0;OHCAR 16:0;OHME606117---416.33557
CAR 18:1CAR 18:1ME606245---426.35635
CAR 18:2CAR 18:2ME606202---424.34091
CAR 2:0CAR 2:0ME606139---204.12238
CAR 20:4CAR 20:4ME606144---448.34033
CAR 3:0CAR 3:0ME606259---218.13783
CAR 4:0CAR 4:0ME606070---232.15338
CAR 4:0;3MeCAR 4:0;3MeME606198---246.1693
CAR 4:0;3OHCAR 4:0;3OHME606116---248.14865
CAR 4:0;OH,MeCAR 4:0;OH,MeME606069---262.1647
CAR 6:0CAR 6:0ME606188---260.18494
CAR 8:0CAR 8:0ME606244---288.21552
CAR DC3:0CAR DC3:0ME606204---248.1124
CarnitineCarnitineME606155---162.11186
CarnosineCarnosineME606156---227.11345
CholineCholineME606157---104.10686
Choline phosphateCholine phosphateME606254---184.07291
cis-4-Hydroxyprolinecis-4-HydroxyprolineME606127---132.06543
CitrullineCitrullineME606158---176.10234
CreatineCreatineME606159---132.07631
CreatinineCreatinineME606160---114.06605
CystathionineCystathionineME606161---223.07437
Cysteine-glutathione disulfideCysteine-glutathione disulfideME606162---427.09412
Cysteine-S-sulfateCysteine-S-sulfateME606265---201.98338
CystineCystineME606163---241.03058
CytidineCytidineME606164---244.09198
CytosineCytosineME606165---112.05044
DeoxycytidineDeoxycytidineME606110---228.09743
DimethylarginineDimethylarginineME606212---203.14966
EctoineEctoineME606294---143.08118
EpigallocatechinEpigallocatechinME606172---307.08267
ErgothioneineErgothioneineME606173---230.09517
EthanolamineEthanolamineME606174---62.0604
H-gamma-glutamyl-glutaminegamma-GlutamylglutamineME606186---276.11826
gamma-Glutamyltyrosinegamma-GlutamyltyrosineME606296---311.12292
Glu-ArgGlu-ArgME606175---304.16068
Glucose 6-phosphateGlucose 6-phosphateME606177---261.03659
Glutamic acidGlutamic acidME606178---148.05998
GlutamineGlutamineME606179---147.07593
GlutathioneGlutathioneME606180---613.1582
Glu-ThrGlu-ThrME606176---249.10757
Gly-ValGly-ValME606181---175.10718
GMPGMPME606185---364.06476
Guanidinosuccinic acidGuanidinosuccinic acidME606183---176.06619
Guanidoacetic acidGuanidoacetic acidME606182---118.06104
GuanineGuanineME606184---152.05655
HexanoylglycineHexanoylglycineME606189---174.11208
HistamineHistamineME606190---112.08691
HistidineHistidineME606191---156.07637
HomoarginineHomoarginineME606192---189.13457
HomocitrullineHomocitrullineME606297---190.11824
HypoxanthineHypoxanthineME606193---137.04536
Imidazoleacetic acidImidazoleacetic acidME606125---127.04993
InosineInosineME606196---269.08759
IsoleucineIsoleucineME606197---132.10162
Kynurenic acidKynurenic acidME606199---190.04932
KynurenineKynurenineME606200---209.09122
L-MetanephrineL-MetanephrineME606206---180.10147
LPA 16:0/0:0LPA 16:0/0:0ME606103---496.33826
1-Myristoyl-sn-glycero-3-phosphocholineLPC 14:0/0:0ME606092---468.30585
1-Pentadecanoyl-sn-glycero-3-phosphocholineLPC 15:0/0:0ME606104---482.32874
LPC 16:1LPC 16:1ME606299---494.32321
LPC 16:2LPC 16:2ME606300---492.30704
1-Heptadecanoyl-sn-glycero-3-phosphocholineLPC 17:0/0:0ME606082---510.35278
LPC 18:0/0:0LPC 18:0/0:0ME606106---524.36896
LPC 18:1/0:0LPC 18:1/0:0ME606096---522.35297
LPC 18:2LPC 18:2ME606301---520.33813
LPC 18:3LPC 18:3ME606302---518.32239
LPC 19:0LPC 19:0ME606303---538.38446
LPC 20:1LPC 20:1ME606304---550.38483
LPC 20:4LPC 20:4ME606305---544.33813
1-Arachidoyl-2-hydroxy-sn-glycero-3-phosphocholineLPC 20:4/0:0ME606080---552.40027
LPC 20:5LPC 20:5ME606306---542.32214
1-Behenoyl-2-hydroxy-sn-glycero-3-phosphocholineLPC 22:0/0:0ME606081---580.43036
LPC 22:1LPC 22:1ME606307---578.41638
LPC 22:6LPC 22:6ME606308---568.33801
1-Lignoceroyl-2-hydroxy-sn-glycero-3-phosphocholin...LPC 24:0ME606086---608.46271
LPC 24:1LPC 24:1ME606309---606.44739
LPC O-16:0LPC O-16:0ME606085---482.36572
LPC P-16:0 or LPC O-16:1LPC P-16:0 or LPC O-16:1ME606076---480.34384
LPC P-18:0 or LPC O-18:1LPC P-18:0 or LPC O-18:1ME606079---508.37433
LPE 16:0/0:0LPE 16:0/0:0ME606100---454.29193
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphoethanolam...LPE 18:0/0:0ME606107---482.32242
LPE 18:1/0:0LPE 18:1/0:0ME606097---480.30716
LPE 18:2LPE 18:2ME606310---478.29175
LysineLysineME606203---147.1123
MethacholineMethacholineME606207---160.1326
MethionineMethionineME606208---150.05798
Methionine sulfoxideMethionine sulfoxideME606209---166.05283
MethylguanidineMethylguanidineME606088---74.07163
N(2)-AcetyllysineN(2)-AcetyllysineME606236---189.12294
N6-AcetyllysineN6-AcetyllysineME606230---189.12277
N6-MethyladenosineN6-MethyladenosineME606135---282.1189
N(6)-MethyllysineN(6)-MethyllysineME606224---161.12808
N(6)-Methyllysine1N(6)-MethyllysineME606238---161.1281
N(6),N(6)-Dimethyl-lysineN(6),N(6)-Dimethyl-lysineME606233---175.14359
N-6-TrimethyllysineN-6-TrimethyllysineME606237---189.15921
N8-AcetylspermidineN8-AcetylspermidineME606235---188.17531
N-AcetylcarnosineN-AcetylcarnosineME606215---269.12534
N-AcetylglutamineN-AcetylglutamineME606231---154.09697
N-AcetylhistidineN-AcetylhistidineME606217---198.08684
N-AcetylmethionineN-AcetylmethionineME606218---192.06818
N-AcetylornithineN-AcetylornithineME606229---175.10727
N-AcetylphenylalanineN-AcetylphenylalanineME606219---208.09607
N-AcetylserotoninN-AcetylserotoninME606214---219.11217
N-Acetyl-tryptophanN-Acetyl-tryptophanME606220---247.10704
NiacinamideNiacinamideME606239---123.055
Nicotinamide N-oxideNicotinamide N-oxideME606240---139.04979
Nicotinamide ribosideNicotinamide ribosideME606241---255.09703
Nicotinic acidNicotinic acidME606242---124.03902
N-MethylhistidineN-MethylhistidineME606222---170.09207
N-MethylisoleucineN-MethylisoleucineME606223---146.1171
N-Methyl-prolineN-Methyl-prolineME606225---130.08606
N-Methyl-valineN-Methyl-valineME606226---132.10153
NormetanephrineNormetanephrineME606170---166.08586
Ophthalmic acidOphthalmic acidME606243---290.13403
OrnithineOrnithineME606246---133.09683
P-Aminobenzoic acidp-Aminobenzoic acidME606122---138.05463
Pantothenic acidPantothenic acidME606250---220.11731
1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholin...PC 16:0/14:0ME606102---706.53711
PC 16:0/18:2PC 16:0/18:2ME606101---758.56726
PC 16:0/22:6PC 16:0/22:6ME606099---806.56738
PC 16:1/16:1PC 16:1/16:1ME606074---730.53668
1-Stearoyl-2-myristoyl-sn-glycero-3-phosphocholinePC 18:0/14:0ME606108---734.56726
1-Stearoyl-2-arachidonyl-sn-glycero-3-phosphocholi...PC 18:0/20:4ME606105---810.59753
PC 18:1/18:1PC 18:1/18:1ME606075---786.59778
PC 18:3/18:3PC 18:3/18:3ME606071---778.54407
1,2-Diarachidonoyl-sn-glycero-3-phosphocholinePC 20:4/20:4ME606072---830.56671
1-Hexadecyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-...PC O-16:0/20:3ME606083---768.58759
1-Hexadecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glyce...PC O-16:0/20:5ME606084---770.59338
1-O-Hexadecyl-2-O-(5Z,8Z,11Z,14Z,17Z-eicosapentaen...PC O-16:0/20:5ME606094---766.57178
1-O-Hexadecyl-2-O-(4Z,7Z,10Z,13Z,16Z,19Z-docosahex...PC O-16:0/22:6ME606093---792.58746
PC O-18:1/20:4PC O-18:1/20:4ME606078---794.60144
PC O-18:1/22:6PC O-18:1/22:6ME606077---818.60303
2-Arachidonoyl-1-palmitoyl-sn-glycero-3-phosphoeth...PE 16:0/20:4ME606114---740.52075
PelargonidinPelargonidinME606228---217.12939
PhencyclidinePhencyclidineME606251---244.19009
PhenylacetylglycinePhenylacetylglycineME606252---194.08052
PhenylalaninePhenylalanineME606253---166.08575
Pipecolic acidPipecolic acidME606255---130.08583
Pro-GlyPro-GlyME606256---173.09169
Pro-hydroxyProPro-hydroxyProME606258---229.11775
ProlineProlineME606257---116.07052
PutrescinePutrescineME606260---89.10747
PyridoxaminePyridoxamineME606261---169.09613
RiboflavinRiboflavinME606262---377.14459
RibothymidineRibothymidineME606134---259.09216
S-AdenosylhomocysteineS-AdenosylhomocysteineME606263---385.12769
S-AdenosylmethionineS-AdenosylmethionineME606264---399.14395
SarcosineSarcosineME606269---90.05511
SerineSerineME606270---106.0498
SerotoninSerotoninME606266---177.10173
SM 18:1;O2/16:0SM 18:1;O2/16:0ME606247---703.57294
SM 18:1;O2/18:0SM 18:1;O2/18:0ME606213---731.60297
SM 18:1;O2/22:0SM 18:1;O2/22:0ME606221---787.6662
sn-Glycero-3-phosphocholinesn-Glycero-3-phosphocholineME606267---258.10913
SpermidineSpermidineME606271---146.16481
SphinganineSphinganineME606268---302.30484
Sphinganine 1-phosphateSphinganine 1-phosphateME606167---382.27048
Sphingosine 1-phosphateSphingosine 1-phosphateME606168---380.25528
SucroseSucroseME606272---365.10406
TaurineTaurineME606273---126.02178
Taurocholic acidTaurocholic acidME606274---516.29755
ThiamineThiamineME606275---265.11136
ThreonineThreonineME606278---120.06536
Thr-GluThr-GluME606277---249.10779
ThymineThymineME606279---127.05001
TriethanolamineTriethanolamineME606111---150.11208
TryptophanTryptophanME606280---205.09659
TyrosineTyrosineME606281---182.08081
UMPUMPME606282---325.04251
UracilUracilME606283---113.03446
UreaUreaME606284---61.03995
Ureidopropionic acidUreidopropionic acidME606121---133.06046
UridineUridineME606285---245.07776
Urocanic acidUrocanic acidME606286---139.04982
ValineValineME606287---118.08612
XanthineXanthineME606288---153.04047
XanthosineXanthosineME606289---285.082
Xanthurenic acidXanthurenic acidME606290---206.04439
1,2-Dilinoleoyl-sn-glycero-3-phosphocholine-ME606073---782.56708
15-Hydroperoxy-5Z,8Z,11Z,13E-eicosatetraenoic acid-ME606109---319.22617
1-Oleoyl-2-myristoyl-sn-glycero-3-phosphocholine-ME606095---732.55042
1-Palmitoyl-2-azelaoylphosphatidylcholine-ME606098---666.43268
(2/3)-amino(iso)butyric acid-ME606068---104.07064
2-(5-Oxovaleryl)phosphatidylcholine-ME606112---594.375
2-Methylquinolin-8-ol-ME606115---160.07516
5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid, 1,5...-ME606130---303.23138
alpha-Asp-Lys-ME606291---262.13925
Arginine, methyl ester-ME606146---189.13425
delta(5)-Hydroxylysine-ME606293---163.10757
D-erythro-N-stearoylsphingosine-ME606166---300.28873
gamma-Glu-epsilon-Lys-ME606295---276.15472
Hemin cation-ME606187---616.17499
Leucine, methyl ester-ME606201---146.1172
N5-(1-Iminoethyl)-ornithine-ME606232---174.12332
N6-(1-Iminoethyl)-lysine-ME606234---188.13889
N-Acetyl-leucine (double check)-ME606216---174.11221
N,N-Diethyl-2-aminoethanol-ME606211---118.12246
N-Oleoyl-D-erythro-sphingosylphosphorylcholine-ME606227---729.58832
Palmitoyleicosapentaenoyl phosphatidylcholine-ME606249---780.55219
Thiazolidine-4-carboxylic acid-ME606276---134.02666


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
10-Hydroxydecanoic acid10-Hydroxydecanoic acidME606338---187.13301
1,2,4-Trihydroxybenzene1,2,4-TrihydroxybenzeneME606364---125.02318
12S-HETE12S-HETEME606324---319.22699
14-HDoHE14-HDoHEME606326---343.22702
2,6-Dihydroxybenzoic acid2,6-Dihydroxybenzoic acidME606328---153.0182
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME606331---147.02888
2-Hydroxyisobutyric acid2-Hydroxyisobutyric acidME606332---103.03886
2-Hydroxyphenylacetic acid2-Hydroxyphenylacetic acidME606333---151.03888
2-Hydroxyquinoline2-HydroxyquinolineME606334---144.04442
2'-O-Methyluridine2'-O-MethyluridineME606327---257.07721
(2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid2-Oxindole-3-acetateME606312---190.05
2-Phosphoglyceric acid2-Phosphoglyceric acidME606336---184.98468
3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acid3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acidME606365---239.09186
3-Hydroxybutyric acid3-Hydroxybutyric acidME606337---103.03883
3-Hydroxydodecanoic acid3-Hydroxydodecanoic acidME606339---215.16443
3-Hydroxyoctanoic acid3-Hydroxyoctanoic acidME606340---159.1017
beta-Hydroxymyristic acid3-Hydroxytetradecanoic acidME606470---243.19609
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME606343---144.06543
4-Guanidinobutanoic acid4-Guanidinobutanoic acidME606344---144.07678
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME606345---121.02833
4-Hydroxybenzoic acid4-Hydroxybenzoic acidME606346---137.02333
4-Nitrophenol4-NitrophenolME606348---138.01848
4-Pyridoxic acid4-Pyridoxic acidME606349---182.04469
Adipic acidAdipic acidME606353---145.04956
AlanineAlanineME606354---88.03925
AllantoinAllantoinME606355---157.0356
AnserineAnserineME606356---239.11438
ArabitolArabitolME606357---151.06009
ArginineArginineME606358---173.10327
Aspartic acidAspartic acidME606362---132.02911
Asp-AsnAsp-AsnME606359---246.07288
Asp-AspAsp-AspME606360---247.05656
Asp-LeuAsp-LeuME606361---245.11353
Azelaic acidAzelaic acidME606363---187.0966
CarnosineCarnosineME606366---225.09839
Cholesterol sulfateCholesterol sulfateME606367---465.30383
Citric acidCitric acidME606368---191.01872
CitrullineCitrullineME606369---174.08733
Coriolic acidCoriolic acidME606325---295.22702
CreatinineCreatinineME606370---112.0507
Cysteine-glutathione disulfideCysteine-glutathione disulfideME606371---425.0799
Cysteine-S-sulfateCysteine-S-sulfateME606447---199.96837
CystineCystineME606372---239.01581
CytidineCytidineME606373---242.07773
DaidzeinDaidzeinME606374---253.05026
DeoxyuridineDeoxyuridineME606330---227.06664
DimethylarginineDimethylarginineME606411---201.13481
Dodecanedioic acidDodecanedioic acidME606375---229.14389
Dodecylbenzenesulfonic acidDodecylbenzenesulfonic acidME606376---325.18222
D-TagatoseD-TagatoseME606454---179.05499
ErgothioneineErgothioneineME606377---228.08052
Fructose 1-phosphateFructose 1-phosphateME606379---259.02274
Fumaric acidFumaric acidME606380---115.00267
GalactitolGalactitolME606473---181.07333
gamma-Glutamylglutaminegamma-GlutamylglutamineME606474---274.10394
gamma-Glutamylleucinegamma-GlutamylleucineME606475---259.12936
gamma-Glutamyltyrosinegamma-GlutamyltyrosineME606476---309.10852
Gluconic acidGluconic acidME606384---195.04999
Glucosamine 6-phosphateGlucosamine 6-phosphateME606385---258.03781
GlucosanGlucosanME606316---161.04446
Glucuronic acidGlucuronic acidME606386---193.03467
Glu-LysGlu-LysME606382---274.14047
Glutamic acidGlutamic acidME606387---146.04466
GlutamineGlutamineME606388---145.06056
Glutaric acidGlutaric acidME606389---131.03386
GlutathioneGlutathioneME606390---611.14386
Glu-ThrGlu-ThrME606383---247.09288
Gly-AspGly-AspME606391---189.05081
GlyceraldehydeGlyceraldehydeME606393---89.02325
Gly-GluGly-GluME606392---203.06659
Guanidoacetic acidGuanidoacetic acidME606394---116.04555
Hexadecanedioic acidHexadecanedioic acidME606396---285.20667
HexanoylglycineHexanoylglycineME606397---172.09685
Hippuric acidHippuric acidME606395---178.05022
HistidineHistidineME606398---154.06105
HypotaurineHypotaurineME606399---108.01129
HypoxanthineHypoxanthineME606400---135.03012
Indolelactic acidIndolelactic acidME606401---204.06573
InosineInosineME606402---267.07291
N-IsobutyrylglycineIsobutyrylglycineME606420---144.0654
IsoleucineIsoleucineME606403---130.08633
IsovalerylglycineIsovalerylglycineME606421---158.08116
Kynurenic acidKynurenic acidME606404---188.03424
LeucineLeucineME606405---130.0863
LPC 14:0LPC 14:0ME606477---512.29742
LPC 16:0LPC 16:0ME606478---540.32941
LPC 16:1LPC 16:1ME606479---538.31409
1-Heptadecanoyl-sn-glycero-3-phosphocholineLPC 17:0/0:0ME606319---554.34521
LPC 18:0LPC 18:0ME606480---568.36053
LPC 18:1LPC 18:1ME606481---566.3443
LPC 18:2LPC 18:2ME606482---564.32892
LPC 18:3LPC 18:3ME606483---562.31378
LPC 19:0LPC 19:0ME606484---582.37762
LPC 20:0LPC 20:0ME606485---596.39233
LPC 20:1LPC 20:1ME606486---594.37622
LPC 20:4LPC 20:4ME606487---588.32947
LPC 20:5LPC 20:5ME606488---586.31421
LPC 22:6LPC 22:6ME606489---612.32947
LPC P-16:0 or LPC O-16:1LPC P-16:0 or LPC O-16:1ME606317---524.33435
LPE 16:0LPE 16:0ME606490---452.27771
LPE 18:0LPE 18:0ME606491---480.30865
LPE 18:1LPE 18:1ME606492---478.29279
LPE 18:2LPE 18:2ME606493---476.27713
LPE 18:3LPE 18:3ME606494---474.26208
LPE 20:4LPE 20:4ME606495---500.27731
LPE 20:5LPE 20:5ME606496---498.26212
LPE 22:6LPE 22:6ME606497---524.2771
LysineLysineME606406---145.09711
Malic acidMalic acidME606407---133.01311
Mannose 6-phosphateMannose 6-phosphateME606408---259.02219
Methionine sulfoxideMethionine sulfoxideME606409---164.03764
Methylsuccinic acidMethylsuccinic acidME606410---131.0338
Myo-inositolMyo-inositolME606498---225.06094
N(2)-AcetyllysineN(2)-AcetyllysineME606425---187.10791
N6-AcetyllysineN6-AcetyllysineME606424---187.10776
N-AcetylalanineN-AcetylalanineME606412---130.0499
N-AcetylhistidineN-AcetylhistidineME606415---196.07178
N-AcetylleucineN-AcetylleucineME606416---172.09685
N-Acetyl-mannosamineN-Acetyl-mannosamineME606417---220.08177
N-AcetylmethionineN-AcetylmethionineME606418---190.05327
N-AcetylornithineN-AcetylornithineME606423---173.09207
N-AcetylphenylalanineN-AcetylphenylalanineME606413---206.08136
N-Acetyl-tryptophanN-Acetyl-tryptophanME606419---245.09251
N-AcetyltyrosineN-AcetyltyrosineME606414---222.0762
N-Methyl-glutamic acidN-Methyl-glutamic acidME606422---160.06049
Octadecanedioic acidOctadecanedioic acidME606428---313.23792
Ophthalmic acidOphthalmic acidME606427---288.11948
Orotic acidOrotic acidME606429---155.00874
Pantothenic acidPantothenic acidME606435---218.10254
PC 16:0/18:2PC 16:0/18:2ME606322---802.56006
PC 16:0/20:4PC 16:0/20:4ME606320---826.56036
PC 16:0/22:6PC 16:0/22:6ME606321---850.56024
PC 36:5PC 36:5ME606431---824.54492
PhenylalaninePhenylalanineME606436---164.07066
Phenyllactic acidPhenyllactic acidME606342---165.05453
Phenylpyruvic acidPhenylpyruvic acidME606437---163.03908
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME606438---166.97418
PhosphoethanolaminePhosphoethanolamineME606426---140.01076
Phosphoric acidPhosphoric acidME606439---96.95883
Phthalic acidPhthalic acidME606440---165.01805
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'...PI 18:0/20:4ME606323---885.54974
PI 34:2PI 34:2ME606432---833.5188
PI 36:4PI 36:4ME606433---857.51935
Pimelic acidPimelic acidME606441---159.06525
Propionic acidPropionic acidME606442---73.02843
PseudouridinePseudouridineME606443---243.06152
Pyroglutamic acidPyroglutamic acidME606444---128.03412
Pyruvic acidPyruvic acidME606445---87.00764
Ribose 5-phosphateRibose 5-phosphateME606446---229.01128
Sebacic acidSebacic acidME606448---201.11218
SerineSerineME606449---104.03416
SM 18:1;O2/16:0SM 18:1;O2/16:0ME606434---747.56573
SorboseSorboseME606450---179.05504
erythro-Sphinganine-1-phosphateSphinganine 1-phosphateME606471---380.25626
Sphingosine 1-phosphateSphingosine 1-phosphateME606472---378.24057
Suberic acidSuberic acidME606501---173.08086
Succinic acidSuccinic acidME606451---117.01803
Sulfoacetic acidSulfoacetic acidME606452---138.96954
TaurineTaurineME606455---124.00616
Taurocholic acidTaurocholic acidME606456---514.2829
Tetradecanedioic acidTetradecanedioic acidME606457---257.1752
Threonic acidThreonic acidME606459---135.02879
ThreonineThreonineME606460---118.04976
Thr-GluThr-GluME606458---247.093
ThymidineThymidineME606461---241.08229
TiglylglycineTiglylglycineME606502---156.06549
trans-4-Hydroxyprolinetrans-4-HydroxyprolineME606453---130.05014
Traumatic acidTraumatic acidME606503---227.12807
TrehaloseTrehaloseME606311---387.11407
Tridecanedioic acidTridecanedioic acidME606313---243.15939
TryptophanTryptophanME606462---203.0817
Undecanedioic acidUndecanedioic acidME606463---215.12802
UracilUracilME606464---111.01887
UridineUridineME606465---243.06154
Urocanic acidUrocanic acidME606466---137.03465
ValineValineME606467---116.07046
XanthineXanthineME606468---151.02495
XanthosineXanthosineME606469---283.06784
1,3-Cyclohexanedicarboxylic acid-ME606314---171.06522
1,4-Cyclohexanedicarboxylic acid-ME606315---171.06505
1-(9Z-Octadecenyl)-sn-glycero-3-phosphoethanolamin...-ME606318---464.31476
2-Benzothiazolesulfonic acid-ME606329---213.96294
2-Mercaptobenzothiazole-ME606335---165.97798
3-Methyl-4-nitrophenol-ME606341---152.03406
4-Hydroxyquinoline-2-carbaldehyde-ME606347---172.0394
6alpha-Mannobiose-ME606350---455.10168
9-Fluorenone-ME606351---179.05513
9-Hydroperoxy-10E,12Z-octadecadienoic acid-ME606352---293.21109
Erythronolactone-ME606378---117.01809
Gentianose-ME606381---549.16705
Oxalic acid mono(N-methyl)amide-ME606430---102.0185
p-Hydroxyphenyllactic acid-ME606499---181.04951
rac-Glycerol 3-phosphoate-ME606500---171.00529


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