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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
1-(1Z-Hexadecenyl)-sn-glycero-3-phosphocholineLPC P-16:0 or LPC O-16:1ME478290--5.407480.3441
12,13-Dihydroxy-9Z-octadecenoic acid12,13-DiHOMEME478214--1.437315.2528
12(13)-Epoxy-9Z-octadecenoic acid12(13)-EpOMEME478192--1.151297.2422
13-Keto-9Z,11E-octadecadienoic acid13-Oxo-ODEME478184--1.032295.2266
1,4-Cyclohexanedicarboxylic acid-ME478219--1.466173.0806
1,4-Dihydroxy-2-naphthoic acid1,4-Dihydroxy-2-naphthoic acidME478253--3.822159.0438
1,5-Isoquinolinediol-ME478330--6.588162.0549
17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid17(18)-EpETEME478213--1.434301.2159
1-Hexadecyl-sn-glycero-3-phosphocholineLPC O-16:0ME478298--5.604482.3602
1-Methyladenosine1-MethyladenosineME478366--7.407282.1195
1-Methylguanosine1-MethylguanosineME478306--5.82298.1145
1-Methylhistamine1-MethylhistamineME478365--7.322126.1025
1-Methylnicotinamide1-Methyl nicotinamideME478321--6.206137.0708
1-Methyl-xanthine1-MethylxanthineME478241--2.926167.0563
1-Monolinoleoyl-rac-glycerol-ME478312--5.994355.2837
1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanola...-ME478309--5.889426.2612
1-O-Hexadecyl-2-O-acetyl-sn-glyceryl-3-phosphorylc...-ME478289--5.386524.3704
1-Oleoyl-sn-glycero-3-phosphocholineLPC 18:1/0:0ME478293--5.507522.3547
1-Oleoyl-sn-glycero-3-phosphoethanolamineLPE 18:1/0:0ME478302--5.769480.3074
1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanola...LPE 16:0/0:0ME478304--5.816454.2922
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphoethanolam...LPE 18:0/0:0ME478301--5.73482.3232
2,3,5-Trimethylpyrazine-ME478255--3.851123.0915
2,8-QuinolinediolQuinoline-2,8-diolME478210--1.364162.0548
2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl...-ME478403--8.158384.1499
2-Aminophenol2-AminophenolME478191--1.144110.06
2-Butoxypyridine-ME478258--3.998152.1068
2'-DeoxyadenosineDeoxyadenosineME478257--3.952252.1089
2'-DeoxyguanosineDeoxyguanosineME478328--6.547268.104
2'-DeoxyinosineDeoxyinosineME478288--5.277505.1782
2-Hydroxyacetophenone-ME478261--4.257137.06
2-Hydroxyfluorene2-HydroxyfluoreneME478239--2.808183.08
2'-O-Methylinosine-ME478260--4.254283.1036
(2R)-3-HydroxyisovaleroylcarnitineCAR 4:0;OH,MeME478353--7.194262.1648
3-Hydroxyanthranilic acid3-Hydroxyanthranilic acidME478211--1.373154.0496
3-HydroxybutyrylcarnitineCAR 4:0;3OHME478376--7.585248.1491
3-IndolemethanolIndole-3-carbinolME478202--1.221148.0755
3-Methylcytidine3-MethylcytidineME478349--7.106258.1083
3-Methylthiopropylamine3-MethylthiopropylamineME478283--5.115106.0683
3'-O-Methylcytidine-ME478286--5.186258.1082
3'-O-Methylinosine-ME478265--4.378283.1036
3-Pyridinemethanol-ME478220--1.491110.0599
4-Acetamidobutyric acid4-Acetamidobutanoic acidME478232--2.255146.081
4-Amino-1-butanol-ME478333--6.71890.0914
4-Aminobenzoic acidp-Aminobenzoic acidME478367--7.434138.0548
4-Aminomethylcyclohexanecarboxylic acid-ME478344--6.938158.1174
4-Aminophenol4-AminophenolME478208--1.323110.0601
4-Guanidinobutyric acid4-Guanidinobutanoic acidME478379--7.67146.0921
4-Hydroxymandelonitrile4-HydroxymandelonitrileME478234--2.415150.0547
4-Methyl-5-thiazoleethanol5-(2-Hydroxyethyl)-4-methylthiazoleME478206--1.272144.0476
5-Acetylamino-6-amino-3-methyluracil5-Acetylamino-6-amino-3-methyluracilME478295--5.556181.0719
5-(Galactosylhydroxy)-L-lysine5-(Galactosylhydroxy)-lysineME478557--10.084325.1605
5-Methyl-5,6-DihydrouracilDihydrothymineME478264--4.332129.0656
5-Methylcytidine5-MethylcytidineME478329--6.551258.1082
5-Methylcytosine5-MethylcytosineME478300--5.728126.066
5'-Methylthioadenosine5'-MethylthioadenosineME478235--2.493298.0966
6-BiopterinBiopterinME478337--6.786238.093
7-Keto-8-aminopelargonic acid8-Amino-7-oxononanoic acidME478315--6.082188.1279
7-Methoxycoumarin-ME478319--6.183177.0545
7-Methylguanosine7-MethylguanosineME478371--7.445298.1146
8-Oxo-2-deoxyadenosine8-Oxo-2'-deoxyadenosineME478276--4.957268.1038
9(10)-Epoxy-12Z-octadecenoic acid9(10)-EpOMEME478182--1.015297.2421
9-Oxo-10E,12Z-octadecadienoic acid9-OxoODEME478217--1.45295.2266
Abietic acidAbietic acidME478180--0.958303.2317
(+)-Abscisic acidAbscisic acidME478203--1.256247.1328
AcetaminophenAcetaminophenME478207--1.315152.0703
AcetylcarnitineCAR 2:0ME478350--7.166204.1227
AcyclovirAciclovirME478313--6.014451.1788
AgmatineAgmatineME478464--8.901131.129
Ala-Ala-ArgAla-Ala-ArgME478517--9.564317.1928
Ala-Ala-LysAla-Ala-LysME478519--9.606289.1866
Ala-AspAla-AspME478472--8.977205.0817
Ala-Asp-LysAla-Asp-LysME478547--9.866333.1769
Ala-GluAla-GluME478463--8.884219.0975
Ala-Glu-ArgAla-Glu-ArgME478534--9.732375.1983
Ala-Gly-ArgAla-Gly-ArgME478525--9.672303.1771
Ala-Gly-LysAla-Gly-LysME478533--9.72275.1712
Ala-IleAla-IleME478381--7.719203.1389
Ala-Ile-ArgAla-Ile-ArgME478466--8.925359.2397
Ala-Ile-LysAla-Ile-LysME478475--9.011331.2337
Ala-Leu-LysAla-Leu-LysME478460--8.861331.2335
Ala-LysAla-LysME478523--9.643218.1496
Ala-PheAla-PheME478374--7.483237.123
Ala-Pro-ArgAla-Pro-ArgME478508--9.422343.2086
Ala-Pro-LysAla-Pro-LysME478516--9.554315.2025
Ala-TriHydroxylated BA-ME478567--5.64480.3317
Ala-TriHydroxylated BA 2-ME478583--5.033480.33148
Ala-Val-ArgAla-Val-ArgME478492--9.222345.2242
Ala-Val-LysAla-Val-LysME478500--9.298317.2181
Aleuritic acid-ME478196--1.172269.2108
Allantoic acidAllantoic acidME478434--8.655177.0618
alpha-Galactosamine-1-phosphate-ME478348--7.088260.0531
.alpha.-Iononealpha-IononeME478215--1.444175.148
.alpha.-L-Asp-Gly-ME478514--9.54191.0661
.alpha.-L-Glu-L-TyrGlu-TyrME478417--8.405311.1234
Androstadienone-ME478340--6.823271.2052
Arg-AlaArg-AlaME478522--9.62246.1559
Arg-Dihydroxylated BA-ME478561--6.636549.4
Arg-GlnArg-GlnME478543--9.831303.1775
Arg-GlyArg-GlyME478538--9.764232.1404
Argininosuccinic acidArgininosuccinic acidME478521--9.615273.1191
Arg-LeuArg-LeuME478438--8.684288.2027
Arg-LysArg-LysME478558--10.167303.2139
Arg-MetArg-MetME478480--9.09306.1592
Arg-PheArg-PheME478437--8.673322.187
Arg-TriHydroxylated BA-ME478562--7.138565.3954
Arg-TrpArg-TrpME478440--8.693361.1977
Arg-ValArg-ValME478484--9.141274.1873
Asn-ArgAsn-ArgME478546--9.855289.1618
Asn-Dihydroxylated BA-ME478572--6.062507.3418
Asn-Dihydroxylated BA 2-ME478573--6.2507.34277
Asn-Ile-LysAsn-Ile-LysME478497--9.252374.2395
Asn-SerAsn-SerME478511--9.452220.0927
Asn-Thr-LysAsn-Thr-LysME478553--9.907362.2027
Asn-TriHydroxylated BA-ME478563--6.814523.3368
AsparagineAsparagineME478450--8.769133.0605
Asp-HisAsp-HisME478550--9.885271.1036
Asp-IleAsp-IleME478404--8.173247.1288
Asp-LeuAsp-LeuME478395--8.046247.1286
Asp-MetAsp-MetME478425--8.517265.0853
Asp-SerAsp-SerME478526--9.674221.0768
Asp-TyrAsp-TyrME478442--8.743297.1081
AtorvastatinAtorvastatinME478209--1.362559.2596
BetaineBetaineME478354--7.196118.0859
Betaine aldehyde cationBetaineME478310--5.899120.1018
BetonicineBetonicineME478384--7.735160.0967
BiotinBiotinME478242--2.936245.0953
Blood Group A Trisaccharide-ME478487--9.168552.1896
CadaverineCadaverineME478477--9.044103.1229
CaffeineCaffeineME478200--1.211195.0875
CapsaicinCapsaicinME478199--1.18306.2063
CarbocysteineS-Carboxymethyl-cysteineME478474--9.001180.0323
CarnitineCarnitineME478386--7.76162.1121
(-)-Caryophyllene oxideCaryophyllene alpha-oxideME478216--1.445221.1899
CatechinCatechinME478282--5.076291.0861
CholineCholineME478285--5.166104.1068
cis-5,8,11,14,17-Eicosapentaenoic acidEPAME478198--1.176303.2317
Citreoviridin-ME478370--7.442425.1914
CreatineCreatineME478398--8.081132.0765
CreatinineCreatinineME478275--4.859114.066
CurcuminCurcuminME478186--1.063369.1331
Cys-Dihydroxylated BA-ME478574--5.34496.3085
CystathionineCystathionineME478551--9.889223.0745
Cys-TriHydroxylated BA-ME478584--6.087512.30353
CytosineCytosineME478307--5.845112.0505
Decanoyl-L-carnitineCAR 10:0ME478262--4.271316.2481
D-erythro-N-stearoylsphingosine-ME478268--4.597300.2896
D-erythro-SphinganineSphinganineME478270--4.693302.3053
Desbenzyldonepezil-ME478271--4.723290.1747
DesloratadineDesloratadineME478279--4.999311.1308
DexpanthenolPantothenolME478227--1.859206.1386
Dihydrobupropion-ME478238--2.775242.1304
Diprotin B (VAL-PRO-LEU)-ME478325--6.485328.2225
Disaccharide 12-ME478505--9.368360.1502
Disaccharide 3-ME478393--8.012365.1053
Disaccharide 6-ME478420--8.439365.105
Disaccharide 7-ME478448--8.759365.1051
Disaccharide 8-ME478462--8.879325.1124
Disaccharide 9-ME478470--8.966343.1233
DL-.alpha.-Aminopimelic acid-ME478394--8.017176.0915
DL-Leu-DL-Val-ME478342--6.84253.1521
DMSODimethyl sulfoxideME478221--1.60479.0212
EthanolamineEthanolamineME478360--7.28362.0602
Finasteridecarboxylic acid-ME478231--2.185403.2585
GalactosamineGalactosamineME478419--8.423180.0864
gamma-Aminobutyric acid and n-methylalanine-ME478388--7.776104.0704
gamma-Glutamylmethioninegamma-GlutamylmethionineME478424--8.48279.1007
.gamma.-Glutamyl-(S)-allyl-L-cysteine-ME478405--8.205291.1006
Gln-AlaGln-AlaME478451--8.775218.1135
Gln-AsnGln-AsnME478510--9.442261.1193
Gln-Dihydroxylated BA-ME478564--6.068521.3579
Gln-Gly-LysGln-Gly-LysME478549--9.877332.1927
Gln-Leu-ArgGln-Leu-ArgME478491--9.204416.261
Gln-TriHydroxylated BA-ME478575--6.834537.35291
Gln-TyrGln-TyrME478410--8.288310.1393
Glu-AlaGlu-AlaME478454--8.811219.0975
Glu-Ala-LysGlu-Ala-LysME478537--9.758347.1924
Glu-Dihydroxylated BA-ME478565--6.203522.3417
Glu-Ile-ArgGlu-Ile-ArgME478483--9.124417.2452
Glu-Leu-LysGlu-Leu-LysME478490--9.199389.2393
GlutamyltyrosineGlu-TyrME478430--8.619311.1237
Glu-TriHydroxylated BA-ME478576--7.125538.33752
Glu-Val-LysGlu-Val-LysME478509--9.435375.2235
Gly-Asn-ArgGly-Asn-ArgME478554--9.922346.1832
Gly-Asn-LysGly-Asn-LysME478555--9.934318.177
GlycineGlycineME478415--8.39976.0393
GlyciteinGlyciteinME478205--1.265285.0754
Gly-Dihydroxylated BA-ME478577--6.87450.32114
Gly-Dihydroxylated BA 2-ME478578--4.308450.32095
Gly-Glu-ArgGly-Glu-ArgME478545--9.847361.1827
Gly-IleGly-IleME478383--7.734189.1232
Gly-Ile-ArgGly-Ile-ArgME478467--8.931345.2241
Gly-Leu-ArgGly-Leu-ArgME478453--8.793345.2239
Gly-PheGly-PheME478377--7.64223.1075
Gly-ProGly-ProME478427--8.568173.0919
Gly-Pro-ArgGly-Pro-ArgME478515--9.542329.1927
Gly-Pro-LysGly-Pro-LysME478518--9.595301.1873
Gly-Thr-LysGly-Thr-LysME478541--9.813305.1816
Gly-TrpGly-TrpME478373--7.476262.1184
Gly-Tyr-AlaGly-Tyr-AlaME478391--7.993310.1393
HeptadecasphinganineC17 SphinganineME478273--4.76288.2895
Hexadecyltrimethylammonium cation-ME478224--1.684284.3309
Hexanoyl-L-carnitineCAR 6:0ME478281--5.061260.1856
hexosamine 1GlucosamineME478449--8.76162.076
hexosamine 2GlucosamineME478469--8.961162.0757
His-AspHis-AspME478539--9.77271.1037
His-GlnHis-GlnME478527--9.674284.1352
His-LeuHis-LeuME478411--8.289269.1606
His-MetHis-MetME478426--8.556287.1168
His-PheHis-PheME478399--8.082303.145
His-SerHis-SerME478530--9.7243.1087
HistamineHistamineME478408--8.283112.0868
His-TriHydroxylated BA-ME478579--7.103546.35284
His-TrpHis-TrpME478397--8.069342.1556
His-TyrHis-TyrME478445--8.755319.1397
His-ValHis-ValME478439--8.69255.145
HordenineHordenineME478263--4.274166.1224
HydromorphoneHydromorphoneME478280--5.013286.1434
Ile-Ala-LysIle-Ala-LysME478489--9.194331.2337
Ile-ArgIle-ArgME478468--8.945288.2029
Ile-HisIle-HisME478455--8.821269.1604
Ile-IleIle-IleME478318--6.166245.1857
Ile-MetIle-MetME478335--6.722263.1422
Ile-ProIle-ProME478361--7.283229.1544
Ile-Val-ArgIle-Val-ArgME478433--8.636387.2709
Indigotin-ME478189--1.089263.0812
Indole-3-carboxaldehyde1H-Indole-3-carboxaldehydeME478187--1.082146.0598
IsoleucineIsoleucineME478356--7.223132.1018
Isosteviol-ME478322--6.221319.2265
Isoxanthohumol-ME478204--1.258355.1537
Jasmonic acidJasmonic acidME478212--1.424193.1222
KaempferolKaempferolME478197--1.175287.0547
LactamideLactamideME478222--1.62690.055
Lacto-N-triaose-ME478512--9.465546.2018
L-Alanyl-L-norleucine-ME478274--4.83203.139
Lauroyl-L-carnitineCAR 12:0ME478252--3.804344.2796
Lauryl diethanolamideLauroyl diethanolamideME478194--1.158288.2531
Leucholic acid-ME478176--4.618522.3783
LeucineLeucineME478346--7.044132.1017
Leu-GlnLeu-GlnME478392--8.01260.1605
Leu-Gly-LeuLeu-Gly-LeuME478336--6.785302.2073
Leu-Ile-LysLeu-Ile-LysME478421--8.45373.2806
Leu/Ile-TriHydroxylated BA-ME478569--4.618522.3783
Leu-Leu-ArgLeu-Leu-ArgME478412--8.371401.2869
Leu-Leu-LysLeu-Leu-LysME478409--8.284373.2805
Leu-PheLeu-PheME478323--6.281279.17
Leu-ProLeu-ProME478351--7.177229.1543
Leu-Val-LysLeu-Val-LysME478441--8.728359.2649
L-HomocitrullineHomocitrullineME478435--8.662190.1184
LinoleoylcarnitineCAR 18:2ME478247--3.233424.3416
L-Leucyl-L-leucine methyl ester-ME478246--3.225259.2016
L-SaccharopineSaccharopineME478542--9.813277.1393
Lys-AsnLys-AsnME478552--9.892261.1557
Lys-Dihydroxylated BA-ME478580--6.775521.39447
Lys-GluLys-GluME478544--9.833276.1554
Lys-LysLys-LysME478559--10.198275.2078
Lys-PheLys-PheME478447--8.757294.181
Lys-SerLys-SerME478548--9.873234.1448
Lys-ThrLys-ThrME478535--9.737248.1603
Lys-TriHydroxylated BA-ME478560--7.284537.3889
Lys-TrpLys-TrpME478446--8.755333.1919
Lys-TyrLys-TyrME478501--9.315310.1761
Malonyl-L-carnitineCAR DC3:0ME478429--8.594248.1127
MaltolMaltolME478190--1.093127.0389
Mepiquat cation-ME478254--3.83114.1277
Met-Ile-ArgMet-Ile-ArgME478413--8.384419.2433
Met-LysMet-LysME478493--9.224278.1532
Met-ProMet-ProME478372--7.446247.111
Met-TriHydroxylated BA-ME478585--6.096540.33441
Met-TyrMet-TyrME478358--7.239313.1211
Monolinolenin (9c,12c,15c)-ME478314--6.075353.2685
(+)-Muscarine cation-ME478292--5.489174.1487
Myristoyl-L-carnitineCAR 14:0ME478249--3.503372.3105
N2,N2-DimethylguanosineN2,N2-DimethylguanosineME478296--5.589312.13
N6,N6,N6-Trimethyl-L-lysineN-6-TrimethyllysineME478498--9.263189.1595
N8-AcetylspermidineN8-AcetylspermidineME478456--8.828188.1754
N-Acetyl-5-hydroxytryptamineN-AcetylserotoninME478218--1.457219.1125
N-Acetyl-D-galactosamineN-Acetyl-D-galactosamineME478266--4.498186.0758
N-Acetyl-D-glucosamineN-Acetyl-D-glucosamineME478359--7.248244.0789
N-Acetyl-D-lactosamineN-AcetyllactosamineME478428--8.591384.1496
N-acetyl lactosamine like-ME478465--8.905384.1495
N-Acetyl-L-carnosineN-AcetylcarnosineME478418--8.408269.1244
N-Acetyl-leucineN-AcetylleucineME478230--2.151174.1124
N-AcetylphenylalanineN-AcetylphenylalanineME478236--2.598208.0965
N-AcetyltryptophanN-Acetyl-tryptophanME478240--2.848247.1075
N-.alpha.-Acetyl-L-arginineN-AcetylarginineME478401--8.098217.1294
N.alpha.-Acetyl-L-lysineN(2)-AcetyllysineME478406--8.235189.1231
N-.alpha.-Acetyl-L-ornithineN-AcetylornithineME478416--8.4175.1075
N-Carboxyethyl-.gamma.-aminobutyric acidN-Carboxyethyl-gamma-aminobutyric acidME478402--8.137176.0915
N-epsilon-AcetyllysineN6-AcetyllysineME478400--8.09189.1231
NicotinamideNiacinamideME478225--1.7123.055
Nicotinamide riboside cationNicotinamide ribosideME478375--7.512255.0974
Nicotinic acidNicotinic acidME478259--4.131124.039
N-Methylglutamic acidN-Methyl-glutamic acidME478414--8.394162.0758
N-MethylhistidineN-MethylhistidineME478488--9.191170.0923
N-MethylisoleucineN-MethylisoleucineME478324--6.443146.1174
N-Methyl-L-threonine-ME478233--2.315116.0705
N-MethyllysineN(6)-MethyllysineME478502--9.342161.1282
N-MethylprolineN-Methyl-prolineME478352--7.183130.0862
N-MethyltyramineN-MethyltyramineME478277--4.979152.1068
N-Methyltyrosine-ME478355--7.205196.0966
N,N-Dimethylarginine ADMA and SDMA-ME478471--8.967203.15
nudifloramide-ME478229--2.148153.0655
Octadecanedioic acidOctadecanedioic acidME478195--1.159315.2528
OctanoylcarnitineCAR 8:0ME478269--4.621288.2169
Oleoyl-L-carnitineCAR 18:1ME478245--3.145426.3573
PalmitoylcarnitineCAR 16:0ME478248--3.281400.3417
Pantothenic acidPantothenic acidME478250--3.564220.1178
Phe-AlaPhe-AlaME478364--7.316237.1232
Phe-ArgPhe-ArgME478444--8.749322.1868
Phe-Dihydroxylated BA-ME478586--2.703540.36719
Phe-Gly-PhePhe-Gly-PheME478331--6.606370.1706
Phe-IlePhe-IleME478299--5.643279.1702
Phe-LysPhe-LysME478461--8.872294.1812
PhenethylaminePhenylethylamineME478272--4.723122.0961
Phenylacetaldehyde B-ME478297--5.603121.0645
PhenylalaninePhenylalanineME478343--6.897166.086
Phenylalanocholic acid-ME478178--5.097556.3624
Phenylethanolamine2-HydroxyphenethylamineME478291--5.421138.0913
Pheophorbide aPheophorbide aME478188--1.087593.2746
Phe-TriHydroxylated BA-ME478571--5.097556.36237
Phe-TrpPhe-TrpME478311--5.908352.1652
Phe-TyrPhe-TyrME478334--6.718329.1491
Phe-Val-LysPhe-Val-LysME478422--8.458393.2491
PhytosphingosinePhytosphingosineME478284--5.165318.3002
Pipecolic acidPipecolic acidME478385--7.755130.0861
PiperinePiperineME478183--1.023286.1436
Prolinamide-ME478357--7.231115.0866
Proline-hydroxyprolinePro-hydroxyProME478457--8.829229.1183
PutrescinePutrescineME478496--9.25189.1073
PyridoxinePyridoxineME478256--3.882170.081
PyroGlu-Met-ME478327--6.512261.0901
PyroGlu-Pro-ME478436--8.673227.1024
Pyroglutamic acidPyroglutamic acidME478452--8.782130.0498
(R)-ButyrylcarnitineCAR 4:0ME478303--5.781232.1541
Retinoic acidRetinoic acidME478179--0.942301.2162
RiboflavinRiboflavinME478316--6.134377.1454
S-Adenosyl-methionineS-AdenosylmethionineME478536--9.757399.144
S-Allyl-L-cysteineS-AllylcysteineME478341--6.827162.0549
SarcosineSarcosineME478389--7.88290.055
Ser-AspSer-AspME478506--9.395221.0766
Ser-Dihydroxylated BA-ME478566--5.766480.3318
Ser-Ile-LysSer-Ile-LysME478486--9.164347.2286
Ser-Leu-ArgSer-Leu-ArgME478476--9.02375.2349
SerotoninSerotoninME478308--5.877177.102
Ser-ProSer-ProME478431--8.62203.1024
Ser-Pro-ArgSer-Pro-ArgME478528--9.675359.2037
Ser-Pro-LysSer-Pro-LysME478524--9.671331.1975
Ser-ThrSer-ThrME478485--9.146207.0975
SertralineSertralineME478237--2.703306.0809
Ser-TriHydroxylated BA-ME478568--6.692496.3262
Ser-TrpSer-TrpME478378--7.644292.1288
Ser-Val-ArgSer-Val-ArgME478507--9.412361.219
Ser-Val-LysSer-Val-LysME478513--9.479333.2127
Sinapyl alcoholSinapyl alcoholME478267--4.556193.0863
sn-Glycero-3-phosphocholinesn-Glycero-3-phosphocholineME478432--8.625258.11
SpermineSpermineME478345--6.943203.2229
S-succinylcysteineSHexCer 39:0;O3ME478495--9.241238.0378
StachydrineStachydrineME478347--7.074144.1018
Stearoyl-L-carnitineCAR 18:0ME478244--3.128428.373
sugar alcohol 2-ME478443--8.748183.0863
sugar alcohol 5-ME478478--9.051367.121
sugar alcohol 6-ME478479--9.068183.0864
(-)-Sulforaphane-ME478193--1.158178.0354
TarginineTarginineME478482--9.095189.1345
Tetrasaccharide 1-ME478529--9.698689.2097
TheobromineTheobromineME478226--1.706181.0718
Thiamine cationThiamineME478339--6.822265.1115
Thr-Ala-LysThr-Ala-LysME478532--9.715319.1972
Thr-ArgThr-ArgME478531--9.707276.1665
Thr-Asp-LysThr-Asp-LysME478556--9.937363.1873
Thr-GlyThr-GlyME478458--8.83177.0868
Thr-Gly-ArgThr-Gly-ArgME478540--9.783333.1879
Thr-Ile-LysThr-Ile-LysME478481--9.091361.2441
Thr-LeuThr-LeuME478380--7.715233.1494
Thr-ProThr-ProME478407--8.25217.1181
Thr-TrpThr-TrpME478368--7.435306.1478
Thr-Val-LysThr-Val-LysME478503--9.348347.2287
ThymineThymineME478228--2.042127.0501
TomatidineTomatidineME478243--2.999416.3521
trans-Vaccenic acidtrans-Vaccenic acidME478185--1.053283.263
trans-Zeatintrans-ZeatinME478305--5.818220.1191
Triethylcitrate-ME478181--0.975277.1278
Trihydroxycholestanoic acidCoprocholic acidME478223--1.665468.3677
Trimethylamine N-oxideTrimethylamine N-oxideME478294--5.55576.0757
Tripropylene glycol-ME478201--1.219193.1432
Trisaccharide 3-ME478504--9.356527.158
Trp-AlaTrp-AlaME478362--7.291276.1342
Trp-GlnTrp-GlnME478390--7.939333.1558
Trp-LysTrp-LysME478459--8.856333.1921
Trp-MetTrp-MetME478326--6.495336.1372
Trp-PheTrp-PheME478317--6.164352.1656
Trp-TriHydroxylated BA-ME478581--5.14595.37274
Trp-TrpTrp-TrpME478320--6.195391.1762
TryptamineTryptamineME478278--4.99161.107
Tyr-ArgTyr-ArgME478494--9.236338.1819
Tyr-Dihydroxylated BA-ME478582--4.652556.362
Tyr-GlnTyr-GlnME478423--8.467310.1395
Tyr-LeuTyr-LeuME478338--6.811295.1649
TyrosineTyrosineME478382--7.719182.08113
Tyrosocholic acid-ME478177--5.696572.3571
Tyr-TriHydroxylated BA-ME478570--5.696572.35712
Tyr-TyrTyr-TyrME478369--7.438345.1438
unknown-ME478287--5.25152.1069
Urocanic acidUrocanic acidME478251--3.668139.0499
Val-ArgVal-ArgME478499--9.263274.1873
Val-Glu-LysVal-Glu-LysME478520--9.614375.2231
ValineValineME478387--7.774118.086
Val-MetVal-MetME478363--7.308249.1265
Val-PheVal-PheME478332--6.704265.1544
Val-ThrVal-ThrME478396--8.051219.1336
Val-Val-LysVal-Val-LysME478473--8.999345.2492


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