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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
dimethylglycineDimethylglycineME623194--8.49104.0706
GABAgamma-Aminobutyric acidME623197--7.59104.0706
cholineCholineME623186--8.28104.107
serineSerineME623263--7.58106.05
hypotaurineHypotaurineME623211--7.92110.0272
histamineHistamineME623205--9.19112.0871
creatinineCreatinineME623191--6.48114.0664
prolineProlineME623257--8.08116.0708
guanidinoacetateGuanidoacetic acidME623203--7.8118.0612
indoleIndoleME623214--1.77118.0652
betaineBetaineME623156--8.94118.0864
valineValineME623275--7.38118.0864
threonineThreonineME623267--7.52120.0658
trimethylbenzeneTrimethylbenzeneME623270--1.76121.1014
niacinamideNiacinamideME623245--3.8123.0555
taurineTaurineME623265--6126.022
5-methylcytosine5-MethylcytosineME623141--6.11126.0663
valine-d8ValineME623127--7.39126.1365
imidazoleacetateImidazoleacetic acidME623213--8.03127.0502
N-methylprolineN-Methyl-prolineME623247--8.61130.0861
pipecolatePipecolic acidME623255--7.96130.0861
N-acetylputrescineN-AcetylputrescineME623241--7.92131.1176
hydroxyprolineHydroxyprolineME623210--7.82132.0654
N-acetylalanineN-AcetylalanineME623235--3.78132.0654
beta-guanidinopropionate3-Guanidinopropanoic acidME623155--7.45132.0765
creatineCreatineME623190--8.26132.0766
isoleucineIsoleucineME623216--7.07132.1017
leucineLeucineME623219--6.94132.1017
asparagineAsparagineME623153--7.83133.0606
N-carbamoyl-beta-alanineUreidopropionic acidME623244--4.08133.0606
ornithineOrnithineME623249--9.27133.097
aspartateAspartic acidME623154--7.88134.0445
homocysteineHomocysteineME623209--7.19136.0423
1-methylnicotinamide1-Methyl nicotinamideME623130--8.23137.0705
anthranilate2-Aminobenzoic acidME623151--1.83138.0545
trigonellineTrigonellineME623268--8.85138.0546
urocanateUrocanic acidME623274--4.57139.0498
imidazole propionateImidazole propanoateME623212--7.42141.0654
methylimidazoleacetateMethylimidazoleacetic acidME623226--8.83141.0654
ectoineEctoineME623196--8.88143.081
proline-betaineProline betaineME623258--9.24144.1014
4-acetamidobutanoate4-Acetamidobutanoic acidME623136--3.38146.0807
butyrobetaine3-DehydroxycarnitineME623160--8.76146.117
acetylcholineAcetylcholineME623143--7.78146.1171
glutamineGlutamineME623199--7.95147.0758
lysineLysineME623221--9.3147.1122
glutamateGlutamic acidME623198--7.53148.0598
methionineMethionineME623222--7150.0577
N1-methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME623228--4.32153.0651
N-acetylhistamineN-AcetylhistamineME623237--7.75154.0968
histidineHistidineME623206--9.26156.076
allantoinAllantoinME623148--3.55159.0505
2-aminooctanoate2-Aminocaprylic acidME623132--6.41160.1323
N6-methyllysineN(6)-MethyllysineME623234--9.61161.1277
carnitineCarnitineME623162--8.77162.1116
methionine sulfoxideMethionine sulfoxideME623223--8.57166.0524
7-methylguanine7-MethylguanineME623142--5.76166.0714
phenylalaninePhenylalanineME623253--6.68166.0853
methyl N-methylanthranilateMethyl N-methylanthranilateME623224--2166.0854
urateUric acidME623273--4.23169.0347
3-methylhistidine3-MethylhistidineME623135--9.75170.0914
pro-glyPro-GlyME623256--8.43173.091
N-acetylleucineN-AcetylleucineME623238--2.77174.1114
phenylalanine-d8PhenylalanineME623126--6.69174.1354
N-acetylornithineN-AcetylornithineME623239--8.35175.1067
arginineArginineME623152--9.08175.1179
N6,N6-dimethyllysineN(6),N(6)-Dimethyl-lysineME623232--10.19175.143
N-acetylaspartateN-Acetylaspartic acidME623236--4.49176.0543
citrullineCitrullineME623187--8.27176.1019
serotoninSerotoninME623264--6.27177.1011
5-hydroxytryptophol5-HydroxytryptopholME623139--1.97178.0853
hippurateHippuric acidME623204--2.55180.0644
tyrosineTyrosineME623272--6.76182.0799
4-pyridoxate4-Pyridoxic acidME623138--4.28184.0592
phosphocholineCholine phosphateME623254--10.75184.072
acisogaAcisogaME623144--5.7185.1272
N1-acetylspermidineN1-AcetylspermidineME623227--9.81188.1745
N6-acetyllysineN6-AcetyllysineME623233--8.34189.1221
homoarginineHomoarginineME623207--9.14189.1333
NMMATarginineME623248--9.35189.1333
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME623231--11.17189.1585
kynurenateKynurenic acidME623217--5.19190.0486
homocitrullineHomocitrullineME623208--8.27190.1173
cotinine N-oxideCotinine N-oxideME623189--6.71193.0958
phenylacetylglycinePhenylacetylglycineME623252--2.69194.0798
4-aminohippurate4-Aminohippuric acidME623137--2.38195.075
DMGVDMGVME623195--7.95202.117
ADMADimethylarginineME623146--9.71203.1489
SDMASymmetric dimethylarginineME623262--9.6203.1489
C2 carnitineCAR 2:0ME623163--8.66204.1217
tryptophanTryptophanME623271--6.46205.0957
N-acetylphenylalanineN-AcetylphenylalanineME623240--3.08208.0955
N-alpha-acetylargininePelargonidinME623243--8.13217.1285
C3 carnitineCAR 3:0ME623164--8.31218.1374
pantothenatePantothenic acidME623250--2.97220.1167
N-acetylgalactosamineN-AcetylgalactosamineME623161--5.38222.0959
2'-deoxycytidineDeoxycytidineME623133--5.98228.0965
2-deoxyuridineDeoxyuridineME623134--3.55229.0803
C4 carnitineCAR 4:0ME623165--8232.1532
cystineCystineME623192--9.12241.0301
anserineAnserineME623150--10.4241.1285
cytidineCytidineME623193--5.83244.092
C5:1 carnitineCAR 5:1ME623168--7.88244.1537
pseudouridinePseudouridineME623259--4.15245.076
biotinBiotinME623159--3.87245.0947
C5 carnitineCAR 5:0ME623167--7.78246.1691
N-acetyltryptophanN-Acetyl-tryptophanME623242--2.79247.1069
C4-OH carnitineCAR 4:0;OHME623166--8.83248.1484
5-methylcytidine5-MethylcytidineME623140--5.98258.1078
alpha-glycerophosphocholinesn-Glycero-3-phosphocholineME623149--10.34258.1095
N-lauroylglycineNAGly 12:0ME623246--2.41258.2058
C6 carnitineCAR 6:0ME623169--7.55260.1849
thiamineThiamineME623266--9.77265.1111
phenylacetylglutaminealpha-N-PhenylacetylglutamineME623251--4.54265.1175
adenosineAdenosineME623145--4.99268.1033
inosineInosineME623215--4.81269.0873
vitamin ARetinolME623276--1.58269.2257
C7 carnitineCAR 7:0ME623170--7.45274.2007
L-alpha-glutamyl-L-LysineGlu-LysME623218--9.59276.1546
1-methyladenosine1-MethyladenosineME623128--7.66282.1187
xanthosineXanthosineME623277--4.34285.0825
N4-acetylcytidineN4-AcetylcytidineME623230--4.25286.1026
C8 carnitineCAR 8:0ME623171--7.32288.2162
1-methylguanosine1-MethylguanosineME623129--5.09298.1137
sphingosineSphingosineME623341--5.77300.2886
sphinganineSphinganineME623342--5.78302.3042
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME623229--5.32312.1293
C10 carnitineCAR 10:0ME623172--7.13316.2471
linoleoyl ethanolamideLinoleoyl-EAME623220--2.01324.2886
C12:1 carnitineCAR 12:1ME623174--6.98342.2627
C12 carnitineCAR 12:0ME623173--6.94344.2782
21-deoxycortisol21-DeoxycortisolME623131--2.03347.2205
cortisolCortisolME623188--2.03363.2154
C14:2 carnitineCAR 14:2ME623177--6.85368.2782
C14:1 carnitineCAR 14:1ME623176--6.78370.2939
C14 carnitineCAR 14:0ME623175--6.78372.3095
C16 carnitineCAR 16:0ME623178--6.67400.3407
C16-OH carnitineCAR 16:0;OHME623179--7.1416.3358
C18:2 carnitineCAR 18:2ME623183--6.63424.3408
C18:1 carnitineCAR 18:1ME623181--6.59426.3565
C18 carnitineCAR 18:0ME623180--6.56428.3721
C18:1-OH carnitineCAR 18:1;OHME623182--7.04442.3516
C20:4 carnitineCAR 20:4ME623184--6.54448.341
glycodeoxycholate/glycochenodeoxycholateGlycodeoxycholic acidME623202--4.19450.3203
C16:0 LPELPE 16:0ME623298--6.23454.2917
glycocholateGlycocholic acidME623201--5.23466.3152
C14:0 LPCLPC 14:0ME623278--7.85468.3073
C18:3 LPELPE 18:3ME623299--6.23476.2737
C18:2 LPELPE 18:2ME623300--6.22478.2918
C18:1 LPELPE 18:1ME623301--6.19480.3078
C16:1 LPC plasmalogenLPC P-16:1 or LPC O-16:2ME623295--7.54480.3437
C18:0 LPE ALPE 18:0ME623302--6.16482.3232
C18:0 LPE BLPE 18:0ME623303--7.78482.3232
C16:1 LPCLPC 16:1ME623279--7.77494.3233
C16:0 LPCLPC 16:0ME623280--7.72496.3387
C20:4 LPELPE 20:4ME623304--6.16502.292
C20:1 LPELPE 20:1ME623305--7.71508.3394
C18:1 LPC plasmalogen ALPC P-18:0 or LPC O-18:1ME623296--7.76508.3753
C18:1 LPC plasmalogen BLPC P-18:0 or LPC O-18:1ME623297--7.44508.3755
C20:0 LPELPE 20:0ME623306--7.66510.3546
C18:3 LPCLPC 18:3ME623281--7.72518.321
C18:2 LPCLPC 18:2ME623282--7.7520.3389
C18:1 LPCLPC 18:1ME623283--7.65522.3541
C18:0 LPCLPC 18:0ME623284--7.6524.3704
C22:6 LPELPE 22:6ME623307--6.14526.2916
C16:0 Ceramide (d18:1)Cer 18:1;O2/16:0ME623343--1.87538.5189
C26 carnitineCAR 26:0ME623185--6.24540.4981
C20:5 LPCLPC 20:5ME623285--7.7542.3212
C20:4 LPC ALPC 20:4ME623286--7.63544.3392
C20:4 LPC BLPC 20:4ME623287--7.51544.3392
C20:3 LPC ALPC 20:3ME623288--7.61546.352
C20:3 LPC BLPC 20:3ME623289--7.5546.3527
C20:1 LPCLPC 20:1ME623290--7.53550.3864
C22:6 LPCLPC 22:6ME623291--7.48568.3378
C22:5 LPCLPC 22:5ME623292--7.48570.3537
C22:4 LPCLPC 22:4ME623293--7.42572.3688
biliverdinBiliverdinME623158--2.01583.2532
bilirubinBilirubinME623157--1.71585.2688
C24:0 LPCLPC 24:0ME623294--7.32608.4634
C24:1 ceramide (d18:1)Cer 18:1;O2/24:1ME623344--1.82648.6258
C14:0 SMSM 18:1;O2/14:0ME623333--7.22675.5381
C34:3 PE plasmalogenPE P-34:2 or PE O-34:3ME623325--5.41700.5227
C16:1 SMSM 18:1;O2/16:1ME623334--7.19701.5544
C34:2 PE plasmalogenPE P-34:1 or PE O-34:2ME623326--5.4702.5385
C16:0 SMSM 18:1;O2/16:0ME623335--7.17703.5698
C30:0 PCPC 30:0ME623308--6.68706.5335
C34:2 PEPE 34:2ME623318--5.46716.518
C34:0 PEPE 34:0ME623319--6.65720.5496
C36:5 PE plasmalogenPE P-36:4 or PE O-36:5ME623327--5.35724.5232
C36:3 PE plasmalogenPE P-36:2 or PE O-36:3ME623315--5.38728.5544
C18:1 SMSM 18:1;O2/18:1ME623336--7.09729.5862
C32:2 PCPC 32:2ME623309--6.63730.5338
C18:0 SMSM 18:1;O2/18:0ME623337--7.09731.6018
C36:4 PEPE 36:4ME623320--5.39740.5186
methylguanidineMethylguanidineME623225--6.8374.0713
C34:3 PC plasmalogenPC P-34:2 or PC O-34:3ME623313--6.54742.5706
C36:2 PEPE 36:2ME623321--5.43744.5499
C38:7 PE plasmalogenPE P-38:6 or PE O-38:7ME623328--5.32748.521
C38:6 PE plasmalogenPE P-38:5 or PE O-38:6ME623329--5.32750.5365
C38:5 PE plasmalogenPE P-38:4 or PE O-38:5ME623330--5.32752.5523
C34:4 PCPC 34:4ME623310--6.56754.5316
C34:3 PCPC 34:3ME623311--6.59756.5467
C20:0 SMSM 18:1;O2/20:0ME623338--7.04759.6309
glycineGlycineME623200--7.8476.0392
trimethylamine-N-oxideTrimethylamine N-oxideME623269--8.1176.0756
C38:6 PEPE 38:6ME623322--5.37764.5164
C36:5 PC plasmalogenPC P-36:4 or PC O-36:5ME623314--6.46766.5679
C38:4 PEPE 38:4ME623323--5.35768.5476
C36:2 PS plasmalogenPS O-36:2ME623332--6.73774.5588
C40:7 PE plasmalogenPE P-40:6 or PE O-40:7ME623331--5.3776.5527
C22:1 SMSM 18:1;O2/22:1ME623339--6.98785.6473
C36:2 PCPC 36:2ME623312--6.55786.5942
C22:0 SMSM 18:1;O2/22:0ME623340--6.98787.6625
C38:7 PC plasmalogenPC P-38:6 or PC O-38:7ME623316--6.43790.5686
C40:6 PEPE 40:6ME623324--5.34792.5481
C38:6 PC plasmalogenPC P-38:5 or PC O-38:6ME623317--6.42792.584
putrescinePutrescineME623260--9.3789.1073
sarcosineSarcosineME623261--8.0890.0549
alanineAlanineME623147--7.7490.055


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