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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_15N2-L-Arginine iSTD-ME728241--9.24177.1116
1_CUDA iSTD-ME72824222978774-1.2341.28
1_D3-1-Methylnicotinamide iSTD-ME728243--6.05140.0895
1_D3-AC(2:0) iSTD-ME72824471308983-7.02207.1421
1_D3-Creatine iSTD-ME72824516213871-7.86135.0948
1_D3-Creatinine iSTD-ME72824612205443-4.86117.0846
1_D3-DL-Alanine iSTD-ME72824716213421-7.8993.0728
1_D3-DL-Aspartic acid iSTD-ME72824846932124-8.99137.0623
1_D3-DL-Glutamic acid iSTD-ME72824971309806-8.54151.078
1_D3-Histamine, N-methyl- iSTD-ME728250--7.19129.1202
1_D3-L-Carnitine iSTD-ME72825171309656-7.57165.1305
1_D5-L-Glutamine iSTD-ME728252--8.38152.107
1_D9-Betaine iSTD-ME72825316213877-7.04127.1425
1_D9-Butyrobetaine iSTD-ME728254--7.58155.1738
1_D9-Caffeine iSTD-ME72825513001304-1.27204.1436
1_D9-Choline iSTD-ME72825616213539-5.09113.1632
1_D9-Crotonobetaine iSTD-ME728257--7.61153.1579
1_D9-TMAO iSTD-ME72825871752814-5.3685.1316
1_Val-Tyr-Val iSTD-ME7282597015709-6.67380.2178
(2R)-3-HydroxyisovaleroylcarnitineCAR 4:0;OH,MeME728260131668011-7262.1636
(3-Carboxypropyl)trimethylammonium-ME728261134C011817.55146.1164
(R)-ButyrylcarnitineCAR 4:0ME728262213144-5.52232.1546
1,3-Dicyclohexylurea1,3-DicyclohexylureaME7282634277-1.09225.1953
1-Methyladenosine1-MethyladenosineME72826427476C024947.19282.1186
1-Methylhistamine1-MethylhistamineME7282653614C051277.17126.1013
1-Methyl-L-histidine1-MethylhistidineME728266352019-8.97170.0913
1-Methylnicotinamide1-Methyl nicotinamideME728267457C029186.05137.0696
1-MonostearinMG 18:0/0:0/0:0ME72826824699D019471.06359.3159
2,2',2''-NitrilotriethanolTriethanolamineME7282697618C067716.45150.1112
2,2-Bis[hydroxymethyl]-2,2',2''-nitrilotriethanol-ME72827081462-6.72210.1313
2'-DeoxycytidineDeoxycytidineME72827113711C008815.85228.0965
2-Methylbutyryl-L-carnitineCAR 4:0;2MeME7282729881339-5.15246.1695
2'-O-Methylcytidine2'-O-MethylcytidineME728273150971-5.1258.107
2-PalmitoylglycerolMG 0:0/16:0/0:0ME728274123409-1.07331.2821
3-alpha.-Galactobiose-ME72827516219440-8.56365.1039
3-HydroxybutyrylcarnitineCAR 4:0;3OHME72827690659885-7.38248.1497
3-HydroxyhexadecanoylcarnitineCAR 16:0;3OHME728277126456228-4.6416.3353
3-Hydroxyoleylcarnitine-ME728278131668118-4.49442.3509
3-MethylglutarylcarnitineCAR DC5:0;3MeME728279128145-5.41290.1585
3-Methyl-histidine3-MethylhistidineME72828064969C011529.19170.0914
4-Guanidinobutyric acid4-Guanidinobutanoic acidME728281500C010357.43146.091
4H-3,1-Benzoxazin-4-one, 6-methyl-2-[(4-methylphen...-ME728282848487-1.4134.0588
4-Methyl-5-thiazoleethanol5-(2-Hydroxyethyl)-4-methylthiazoleME7282831136C042946.65144.0463
5.alpha.-Cholest-7-en-3.beta.-olLathosterolME72828491746543-1.02369.3508
5'-S-Methyl-5'-thioadenosine5'-MethylthioadenosineME728285439176C001702.47298.0959
7-Methyladenine7-MethyladenineME72828671593C022415.96150.0759
7-Methylguanine7-MethylguanineME728287135398679C022425.28166.0707
8-Oxo-2-deoxyadenosine8-Oxo-2'-deoxyadenosineME728288124925-5.13268.1052
Acetyl coenzyme AAcetyl-CoAME728289444493C000249.29810.1297
AcetylcarnitineCAR 2:0ME728290439756C025716.98204.1234
AcetylcholineAcetylcholineME728291187C019963.06146.1161
AdenineAdenineME728292190C001474.62136.061
AdenosineAdenosineME72829360961C002124.91268.1037
Adenosine 5'-diphosphateADPME7282946022C000089.88428.0345
Adenosine 5'-diphosphoriboseADP-riboseME72829533576-9.62560.0759
Adenosine 5'-monophosphateAMPME7282966083C000208.79370.0503
Adenosine-3-monophosphate3'-AMPME72829741211C013678.78348.0697
Adenylosuccinic acidAdenylsuccinic acidME728298440122-9.39464.0791
Ala-AlaAla-AlaME7282995460362C009938.12161.0912
Ala-GlnAla-GlnME728300123935-8.82218.1119
Ala-ThrAla-ThrME7283016427004-8.47191.1012
alpha-Methylhistidine-ME7283024396761-8.76170.0913
AnserineAnserineME728303112072C012629.28241.1292
Arabinofuranosyluracil 5'-monophosphate-ME72830418817-8.89369.0049
ArginineArginineME7283056322C000629.23175.1187
Aspartic acidAspartic acidME7283065960C000498.99134.0436
Benzyldimethylstearylammonium-ME72830731205-1.52360.3607
BetaineBetaineME728308247C007197.03118.0864
CarnitineCarnitineME72830910917C003187.57162.1126
CarnosineCarnosineME728310439224C003869.32-
CholineCholineME728311305C001145.1104.107
CitrullineCitrullineME7283129750C003278.61-
Cocamidopropyl Betaine-ME72831320280-4.75343.2935
CorticosteroneCorticosteroneME7283145753C021401.24347.2197
CreatineCreatineME728315586C003007.86132.0767
CreatinineCreatinineME728316588C007914.85114.0663
CytidineCytidineME7283176175C004756.73-
Cytidine 5'-diphosphate ethanolamineCDP-EthanolamineME728318123727C005709.66447.0651
Cytidine 5'-diphosphocholineCDP-cholineME72831913804C003079.61-
Decanoyl-L-carnitineCAR 10:0ME72832011953821C032993.97316.2468
Ethylhexadecyldimethylammonium-ME72832131281-1.53298.3453
Flavin-adenine-dinucleotideFADME728322643975C000169.36786.1622
Flavine mononucleotide-ME728323643976C000618.44457.1096
FructoseFructoseME7283245984C109067.61203.0511
Galacto-N-biose-ME728325441248C072788.23406.1294
gamma-Glutamylleucinegamma-GlutamylleucineME728326151023-7.77261.1437
Glucose 1-phosphateGlucose 1-phosphateME728327439165-9.46283.0176
Glutamic acidGlutamic acidME72832833032C000258.55148.0599
GlutamineGlutamineME728329738C003038.33147.0747
Glutathione (oxidized)GlutathioneME72833065359C001279.93613.1575
Glutathione (reduced)GlutathioneME728331124886C000518.83308.0896
GuanineGuanineME728332135398634C002426.28152.0553
GuanosineGuanosineME728333135398635C003876.99284.0972
Guanosine 5'-monophosphateGMPME728334135398631C001449.37-
Hexanoyl-L-carnitineCAR 6:0ME7283353246938-4.81260.1855
His-GlyHis-GlyME728336101179-9.31213.0968
HistamineHistamineME728337774C003888.1-
HistidineHistidineME7283386274C001359.16156.0759
His-ValHis-ValME7283397021870-8.47255.1436
HypoxanthineHypoxanthineME728340790C002624.88137.0455
InosineInosineME728341135398641C002946.13269.0883
Inosine 5'-monophosphateIMPME728342135398640C001309.08349.0538
IsoleucineIsoleucineME7283436306C004076.99132.1007
IsomaltoseIsomaltoseME728344439193C002527.77365.1032
L-Arachidonoylcarnitine-ME728345136212424-2.71448.3396
Lauric acid diethanolamide-ME7283468430-1.21288.2518
L-Cysteine-glutathione disulfideS-Glutathionyl-cysteineME7283474247235-9.87427.0928
Leu-LeuLeu-LeuME72834876807-5.88245.1844
LinoleoylcarnitineCAR 18:2ME7283496450015-12.48424.3399
LysineLysineME7283505962C000479.31-
Malonyl-L-carnitineCAR DC3:0ME72835191825606-8.37248.1125
MaltotrioseMaltotrioseME72835292146-9.38527.1556
Mannose 6-phosphateMannose 6-phosphateME72835365127C002759.57-
MethionineMethionineME7283546137C000737.2-
MethioninesulfoxideMethionine sulfoxideME728355158980C029898.33166.0517
Methyltestosterone17-MethyltestosteroneME7283566010C071981.1303.2304
myo-Inositol-3-phosphateInositol 3-phosphateME728357107737C011779.56261.036
Myristoyl-L-carnitineCAR 14:0ME72835853477791-3.15372.3095
N-(3-(Aminomethyl)benzyl)acetamidine-ME7283591433-3.28178.1326
N,N,N-trimethyllysineN-6-TrimethyllysineME728360159659-9.06189.1592
N,N-Diethyl-2-aminoethanol-ME7283617497-4.76118.1212
N,N-DimethylarginineDimethylarginineME72836217801140-8.74203.1492
N-.alpha.-(tert-Butoxycarbonyl)-L-histidine-ME72836387308-9.32110.0701
N.epsilon.-Methyl-L-lysine-ME728364541646-9.08161.127
N8-AcetylspermidineN8-AcetylspermidineME728365123689C010298.67188.1744
N-Acetyl-L-carnosineN-AcetylcarnosineME7283669903482-8.17269.1231
NicotinamideNiacinamideME728367936C001531.63123.055
beta-Nicotinamide adenine dinucleotide hydrate-ME72836825162925-9.37664.1132
beta-nicotinamide adenine dinucleotideNADME728369127255362-9.57664.1121
Nicotinamide ribosideNicotinamide ribosideME728370439924C031507.24255.0958
N-MethylisoleucineN-MethylisoleucineME728371560437-6.28146.1161
N-MethylvalineN-Methyl-valineME7283724378-6.88132.1002
NorleucineNorleucineME72837321236C019336.79132.1008
N-tert-Butoxycarbonyl-b-nornicotryine-ME7283744076426-7.38189.0744
N-Tetracosenoyl-4-sphingenine-ME7283755283568-1.03648.6264
NudifloramideN1-Methyl-2-pyridone-5-carboxamideME72837669698C058422.18153.0646
OctanoylcarnitineCAR 8:0ME72837711953814C028384.4288.2156
Oleoyl-L-carnitineCAR 18:1ME72837846907933-2.78426.3561
PalatinosePalatinoseME72837983686-8.57360.1484
Palmitoyl sphingomyelinSM 18:1;O2/16:0ME7283809939941-4.95725.5537
PalmitoylcarnitineCAR 16:0ME728381461-2.91400.3407
PanthenolPantothenolME728382131204C059441.82206.137
Pantothenic acidPantothenic acidME7283836613C008643.65220.1175
PhenylalaninePhenylalanineME728384994C020576.65166.0858
PhosphocholineCholine phosphateME728385135437-9.12184.0722
Pro-GlnPro-GlnME7283867408109-8.45244.128
ProlineProlineME728387145742C001487.54116.0691
PropionylcarnitineCAR 3:0ME728388107738C030176.16218.1387
Pro-ProPro-ProME72838911622593-7.7213.1219
Protoporphyrin IXProtoporphyrinME7283904971-1.45563.2621
Pyroglutamic acidPyroglutamic acidME728391439685C022378.37130.0497
PyroGlu-Val-Lys-ME72839291746335-7.88357.2115
RaffinoseRaffinoseME728393439242C004929.38505.1737
RiboflavinRiboflavinME728394493570C002555.9377.1433
S-Adenosyl-L-homocysteineS-AdenosylhomocysteineME728395439155C000218.54385.127
S-Adenosyl-L-methionineS-AdenosylmethionineME72839634755C000199.5399.1428
SDMASymmetric dimethylarginineME728397169148-8.68203.1491
SerineSerineME7283985951C000658.45106.0485
SerotoninSerotoninME7283995202C007801.54177.1101
S-LactoylglutathioneS-LactoylglutathioneME728400119450-8.71380.11
StachydrineStachydrineME728401554-6.89144.1015
Stearoyl-L-carnitineCAR 18:0ME72840252922056-2.69428.3711
Succinic acidSuccinic acidME7284031110C000424.62119.0339
SucroseSucroseME7284045988C000898.67365.1042
Taurocholic acidTaurocholic acidME7284056675-6.01516.2963
ThiamineThiamineME7284061130C003786.65265.1111
Thiamine monophosphateThiamine monophosphateME7284073382778-9.39345.0759
ThioninThioninME728408462371-9.04137.0455
ThreonineThreonineME72840999289C055198.15120.064
trehaloseTrehaloseME72841010871590-8.68360.1486
Tri-2-ethylhexyl trimellitate-ME72841118725-0.95547.3962
TrigonellineTrigonellineME7284125570C010047.25138.0542
Trimethylamine-N-oxideTrimethylamine N-oxideME7284131145C011045.476.0751
Tris(2-butoxyethyl) phosphate-ME7284146540C144461399.248
TryptophanTryptophanME7284156305C000786.61-
TuranoseTuranoseME7284165460935C196368.25360.1481
TyrosineTyrosineME7284176057C000827.45-
UridineUridineME7284186029C002994.91245.0751
Uridine 5'-monophosphateUMPME7284196030C001058.89325.0421
Uridine-5-diphosphoacetylgalactosamineUDP-N-acetylgalactosamineME72842023700-9.56608.0858
Uridine-5-diphosphoacetylglucosamineUDP-N-acetylglucosamineME728421643981-9.68608.0867
Urocanic acidUrocanic acidME728422736715C007853.79139.0491
Val-SerVal-SerME7284236992639-8.15205.1169
XanthineXanthineME7284241188C003855.47153.0394


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