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Analysis: Reversed phase 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
spermidineSpermidineME8737591102C00315--
hypoxanthineHypoxanthineME873760-C00262--
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME873761440120C03793--
5-methylthioadenosine (MTA)5'-MethylthioadenosineME873762439176C00170--
carnosineCarnosineME873763439224C00386--
histamineHistamineME873764774C00388--
isoleucineIsoleucineME8737656306C00407,C06418,C16424--
leucineLeucineME8737666106C00123--
ornithineOrnithineME8737676262C00077--
glutathione, oxidized (GSSG)Oxidized glutathioneME87376865359C00127,D00031--
pyridoxalPyridoxalME8737691050C00250--
taurineTaurineME8737701123C00245--
ureaUreaME8737711176C00086--
tryptophanTryptophanME8737726305C00078--
valineValineME8737736287C00183--
adenosineAdenosineME87377460961C00212--
cysteineCysteineME8737755862C00097--
trans-4-hydroxyprolinetrans-4-HydroxyprolineME8737765810C01157--
xanthurenateXanthurenic acidME8737775699C02470--
kynurenineKynurenineME873778161166C00328--
trigonelline (N'-methylnicotinate)TrigonellineME8737795570C01004--
cysteine-glutathione disulfideS-Glutathionyl-cysteineME8737803080690R00900--
N6-carboxymethyllysineN(6)-Carboxymethyl-lysineME873781123800---
dimethylarginine (SDMA + ADMA)DimethylarginineME873782-C03626,C21189--
cysteinylglycine disulfide*Cysteinylglycine disulfideME87378322833544---
fructosyllysineFructosyllysineME8737849839580---


Analysis: Reversed phase 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
biliverdinBiliverdinME8737855280353C00500--
sphingosineSphingosineME8737865280335C00319--
sphinganineSphinganineME8737873126C00836--
retinol (vitamin A)RetinolME873788445354C00473--
spermineSpermineME8737891103C00750--
bilirubin (Z,Z)BilirubinME8737905280352C00486--
alpha-tocopherolalpha-TocopherolME87379186472C02477--
hemeHemeME87379226945C00032--
sphinganine-1-phosphateSphinganine 1-phosphateME873793520---
12-HETE12-HETEME8737945283155C14777--
gamma-tocopherol/beta-tocopherolbeta-tocopherolME873795-C02483,C14152--


Analysis: Reversed phase 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
12,13-DiHOME12,13-DiHOMEME87379610236635C14829--
9,10-DiHOME9,10-DiHOMEME8737979966640C14828--
linoleate (18:2n6)Linoleic acidME8737985280450C01595--
adenosine 3',5'-cyclic monophosphate (cAMP)3',5' cyclic AMPME8737996076C00575--
arachidonate (20:4n6)Arachidonic acidME873800444899C00219--
corticosteroneCorticosteroneME8738015753C02140--
histidineHistidineME8738026274C00135--
inosineInosineME8738036021C00294--
riboflavin (vitamin B2)RiboflavinME873804493570C00255--
pyruvatePyruvic acidME8738051060C00022--
oleoyl ethanolamideOleoyl-EAME8738065283454---
eicosapentaenoate (EPA; 20:5n3)EPAME873807446284C06428--
3-methyl-2-oxovalerate3-Methyl-2-oxovaleric acidME873808-C03465,C00671,C06008--
3-methylhistidine3-MethylhistidineME87380964969C01152--
anserineAnserineME873810112072C01262--
4-methyl-2-oxopentanoateKetoleucineME87381170C00233--
docosahexaenoate (DHA; 22:6n3)DHAME873812445580C06429--
alpha-hydroxyisocaproate2-Hydroxyisocaproic acidME873813-C03264--
pyridoxate4-Pyridoxic acidME8738146723C00847--
docosapentaenoate (n3 DPA; 22:5n3)DPAME8738156441454C16513--
alpha-hydroxyisovalerate2-Hydroxy-3-methylbutyric acidME87381699823---
2-hydroxy-3-methylvalerate2-Hydroxy-3-methyl-pentanoic acidME873817164623---
docosapentaenoate (n6 DPA; 22:5n6)Docosapentaenoic acid (22n-6)ME8738186441454C16513--
13-HODE + 9-HODEHODEME873819-C14762,C14767--
N-oleoyltaurineNA-Taurine 18:1(9Z)ME8738206437033---
linoleoyl ethanolamideLinoleoyl-EAME8738215283446---
14-HDoHE/17-HDoHE-ME873822----


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
3-hydroxybutyrate (BHBA)3-Hydroxybutyric acidME873823-C03197,C01089--
cystineCystineME87382467678C00491--
hypotaurineHypotaurineME873825107812C00519--
2-aminoadipatealpha-Aminoadipic acidME87382692136C00956--
lactateLactic acidME873827612C00186--
glucoseGlucoseME8738285793C00031--
alpha-ketobutyrate3-Methyl pyruvic acidME87382958C00109--
urateUric acidME8738301175C00366--
sphingosine 1-phosphateSphingosine 1-phosphateME8738315283560C06124--
3-methyl-2-oxobutyrateKetoisovaleric acidME87383249C00141--
ascorbic acid 2-sulfateAscorbic acid 2-sulfateME87383354676864---


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