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Analysis: HILIC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
1,5-Anhydro-D-glucitol1,5-AnhydrosorbitolME399809--6.358-
1-Methylhistidine1-MethylhistidineME39981192105C011527.117-
1-Methylnicotinamide1-Methyl nicotinamideME399812457C0291812.826-
2-Furoylglycine2-FuroylglycineME39981421863-2.82-
2-Hydroxy-3-methylbutyric acid2-Hydroxy-3-methylbutyric acidME39981599823-2.684-
2-Hydroxy-3-methylbutyric acid_22-Hydroxy-3-methylbutyric acidME399816--1.853-
Oxoglutaric acid2-Oxoglutaric acidME39995051C000269.606-
3-Furoic acid3-Furoic acidME39982210268-10.964-
3-Hydroxyanthranilic acid3-Hydroxyanthranilic acidME39982386C006322.796-
3-Hydroxybutyric acid3-Hydroxybutyric acidME399824441C010893.265-
3-Pyridinol3-HydroxypyridineME399829--2.792-
3-Methylcrotonylglycine3-MethylcrotonylglycineME399826169485-6.733-
3-Methylhistidine3-MethylhistidineME39982764969C011527.317-
Skatole3-MethylindoleME399966--6.749-
3-methylphenylacetic acid3-Methylphenylacetic acidME39982812121-1.788-
4-Ethylphenol4-EthylphenolME39983031242C136371.669-
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME399831126C006337.597-
4-Pyridoxic acid4-Pyridoxic acidME3998346723C008471.683-
5-Hydroxyindole-3-acetic acid5-Hydroxyindoleacetic acidME399835--6.07-
6-Methylquinoline6-MethylquinolineME3998367059-6.746-
7-Methylxanthine7-MethylxanthineME39983768374C163533.225-
Adrenic acidAdrenic acidME3998405497181C165271.297-
L-AlanineAlanineME3999075950C000418.551-
Alpha-Linolenic acidalpha-Linolenic acidME3998415280934C064271.225-
Aminoadipic acidAminoadipic acidME399842469C009569.031-
D-(-)-ArabinoseArabinoseME399861--8.46-
Arachidonic acidArachidonic acidME399843444899C002191.309-
L-ArginineArginineME3999086322C0006213.734-
L-AsparagineAsparagineME3999096267C001528.902-
L-Aspartic acidAspartic acidME3999105960C000499.164-
BetaineBetaineME399845247C007195.835-
BilirubinBilirubinME3998465280352C004861.547-
CaffeineCaffeineME3998472519C074811.823-
Capric acidCapric acidME3998482969C015711.414-
octanoate radicalCaprylic acidME399946119389-1.551-
DecanoylcarnitineCAR 10:0ME39986510245190-1.837-
PalmitoylcarnitineCAR 16:0ME399953--1.708-
L-AcetylcarnitineCAR 2:0ME3999061C025715.811-
PropionylcarnitineCAR 3:0ME399958107738C030174.55-
HexanoylcarnitineCAR 6:0ME3998946426853-2.855-
L-CarnitineCarnitineME3999112724480C003187.519-
L(-)-CarnitineCarnitineME399904--6.388-
CholineCholineME399849305C0011411.154-
4-Hydroxyprolinecis-4-HydroxyprolineME3998335810C011578.425-
cis-Aconitic acidcis-Aconitic acidME399850643757C0041710.761-
Citraconic AcidCitraconic acidME399851643798C022263.093-
Citric acidCitric acidME399852311C0015810.974-
CitrullineCitrullineME3998539750C003279.323-
CortisolCortisolME3998545754C007351.784-
CotinineCotinineME399855408-1.829-
CoumarinCoumarinME399856323C058517.58-
CreatineCreatineME399857586C003008.562-
CreatinineCreatinineME399858588C007914.172-
Crotonic acidCrotonic acidME399859--8.535-
CystathionineCystathionineME399860--9.986-
L-CystineCystineME39991267678C004919.451-
D-2-Hydroxyglutaric acidD-2-Hydroxyglutaric acidME399864439391C010879.482-
Deoxycholic acidDeoxycholic acidME399866222528C044831.636-
8,11,14-Eicosatrienoic acidDihomo-gamma-linolenic acidME3998385280581C032421.305-
Docosahexaenoic AcidDocosahexaenoic acidME399873445580C064291.302-
Docosapentaenoic AcidDocosapentaenoic acidME399874--1.303-
EcgonineEcgonineME399878443003C108586.025-
Eicosapentaenoic AcidEicosapentaenoic acidME399879446284C064281.319-
L-ErgothioneineErgothioneineME399913--8.509-
Ethylmalonic acidEthylmalonic acidME39988011756-2.841-
D-FructoseFructoseME399868439709C023367.176-
Gamma-Aminobutyric acidgamma-Aminobutyric acidME399881119C003348.847-
D-Saccharic acidGlucaric acidME399877--10.39-
Gluconic acidGluconic acidME39988210690C002578.213-
GlucosamineGlucosamineME399883439213C003298.366-
D-GlucoseGlucoseME3998695793C000318.525-
β-D-Glucopyranuronic acidGlucuronic acidME399985--8.381-
L-Glutamic acidGlutamic acidME39991433032C000258.847-
L-GlutamineGlutamineME3999155961C000648.795-
L-Glyceric acidGlyceric acidME3999166326776-6.094-
Glycerophospho-N-palmitoyl ethanolamineGlycerophospho-N-palmitoyl ethanolamineME399886--1.693Reference-2955
GlycineGlycineME399887750C000379.148-
Glycocholic acidGlycocholic acidME39988823617285C019212.809-
Glycoursodeoxycholic acidGlycoursodeoxycholic acidME39988912310288-1.605-
Glyoxylic acidGlyoxylic acidME399890760C000488.502-
Guanidineacetic acidGuanidoacetic acidME399891--9.273-
GuanineGuanineME399892764C002425.158-
GuvacolineGuvacolineME399893--2.986Reference-6135
Hippuric acidHippuric acidME399895464C015862.811-
L-HistidineHistidineME3999176274C001358.479-
Hydroxyisocaproic acidHydroxyisocaproic acidME39989683697-1.81-
DL-4-Hydroxyphenyllactic acidHydroxyphenyllactic acidME399870--3.73-
HypoxanthineHypoxanthineME399897790C002624.915-
Imidazolelactic acidImidazolelactic acidME399898459122C051326.055-
Indole-3-lactic acidIndole-3-lactic acidME399900--2.931-
Methyl indole-3-acetateIndole-3-methyl acetateME399934--2.816-
Indole-3-acetic acidIndoleacetic acidME399899--3.458-
Indole-3-pyruvic acidIndolepyruvateME399901--2.819-
2-OxindoleIndolin-2-oneME399820--2.797Reference-616
3-Indoxyl sulphateIndoxyl sulfateME399825--2.824-
InosineInosineME3999026021C002946.144-
L-IsoleucineIsoleucineME3999186306C004076.174-
16-Hydroxyhexadecanoic acidJuniperic acidME399810--1.328-
Kojic acidKojic acidME3999033840C145162.814-
L-KynurenineKynurenineME399919161166C003286.068-
L-Lactic acidLactic acidME399920107689C001863.509-
Dodecanoic acidLauric acidME3998753893C026791.367-
L-LeucineLeucineME3999216106C001235.826-
L-LysineLysineME3999225962C0004713.276-
Malic acidMalic acidME399931525C007119.929-
Malonic acidMalonic acidME399932867C003837.154-
D-(-)-MannitolMannitolME399862--7.921-
D-MannoseMannoseME39987218950C001597.965-
α,α-TrehaloseMelibioseME399984--9.544-
L-MethionineMethionineME3999236137C000736.395-
Methionine sulfoxideMethionine sulfoxideME399933847-7.66-
Myo-inositolMyo-inositolME399935-C001379.985-
Myristic AcidMyristic acidME39993611005C064241.342-
N6-Acetyl-L-lysineN6-AcetyllysineME39993992832C027277.434-
N6,N6,N6-Trimethyl-L-lysineN-6-TrimethyllysineME399938440120C0379312.006-
N-Acetyl-L-alanineN-AcetylalanineME39994188064-3.11-
N-Acetylglutamic acidN-Acetylglutamic acidME399940185C006248.755-
N-AcetylornithineN-AcetylornithineME399942439232C004377.829-
N-BenzylformamideN-benzylformamideME399943--7.598-
NicotinamideNiacinamideME399944--2.782-
Oleic AcidOleic acidME399947445639C007121.309-
OrnithineOrnithineME3999496262C0007712.478-
Palmitic AcidPalmitic acidME399951985C002491.328-
Pantothenic acidPantothenic acidME399954988C008643.202-
Pentadecanoic acidPentadecylic acidME39995513849C165371.334-
L-PhenylalaninePhenylalanineME3999246140C000795.01-
Pipecolic acidPipecolic acidME399957849C004087.001-
L-ProlineProlineME399925145742C001487.22-
PseudouridinePseudouridineME39995915047C020676.819-
Pyroglutamic acidPyroglutamic acidME3999607405C018794.69-
Pyruvic acidPyruvic acidME3999611060C000222.856-
D-(-)-Quinic acidQuinic acidME399863--7.165-
8-HydroxyquinolineQuinolin-8-olME399839--6.746-
Quinolinic acidQuinolinic acidME3999621066C037229.368-
Salicylic acidSalicylic acidME399963338C008051.782-
2-Hydroxyhippuric acidSalicyluric acidME399819--2.81-
SarcosineSarcosineME3999641088C002138.075-
L-SerineSerineME3999265951C000659.141-
Shikimic acidShikimic acidME3999658742C004938.099-
Palmitoyl sphingomyelinSM 18:1;O2/16:0ME399952--1.47-
S-Methyl-L-cysteine-S-oxideS-Methylcysteine S-oxideME399967--6.811-
Glycerol 3-phosphatesn-Glycero-3-phosphateME399885439162C000939.238-
Sorbic acidSorbic acidME399968--1.843-
D-Erythro-sphingosine 1-phosphateSphingosine 1-phosphateME399867--2.816-
DL-StachydrineStachydrineME399871--5.111Reference-837
Stearidonic AcidStearidonic acidME3999695312508C163001.243-
Succinic acidSuccinic acidME3999701110C000429.34-
SucroseSucroseME3999715988C000898.955-
Symmetric dimethylarginineSymmetric dimethylarginineME399972169148-11.71-
L-(+)-Tartaric acidTartaric acidME399905--10.462-
TaurineTaurineME3999731123C002458.423-
Taurochenodeoxycholic acidTaurochenodeoxycholic acidME399974--1.465-
Testosterone sulfateTestosterone sulfateME399975119207-1.306-
TheophyllineTheophyllineME3999762153C071302.72-
L-ThreonineThreonineME3999276288C001888.221-
trans-3-Hydroxycotininetrans-3-HydroxycotinineME399977--1.845-
2-Hydroxycinnamic acidtrans-o-Coumaric acidME399818637540C017727.591Reference-168
TrigonellineTrigonellineME3999785570C010046.354-
Trimethylamine N-oxideTrimethylamine N-oxideME3999791145C011045.146-
L-TryptophanTryptophanME3999286305C000786.756-
L-TyrosineTyrosineME3999296057C000827.583-
Uric acidUric acidME3999801175C003667.419-
UridineUridineME3999816029C002994.682-
Urocanic acidUrocanic acidME399982736715C007856.624-
L-ValineValineME3999306287C001837.013-
Ascorbic acidVitamin CME39984454670067C000728.185-
XylitolXylitolME399983--7.076-
2,4-Dihydroxybenzoic acid-ME3998131491-1.597Reference-156
2-Hydroxybenzothiazole-ME399817--1.921Reference-3040
2-Phenylphenol-ME399821--1.597Reference-3105
4-Hydroxybutyric acid (GHB)-ME399832--1.859Reference-1486
(5Z)-3-aminonon-5-enoic acid-ME399808--4.769Autoprocessed-2392
D-Ribono-1,4-lactone-ME399876--8.964Reference-371
Glucuronic acid-3,6-lactone-ME399884--2.759Reference-369
N-(2-hydroxyphenyl)acetamide-ME399937--6.743Autoprocessed-2388
N-Phenylacetylglutamine-ME399945--1.857Reference-541
Oleoyl-L-α-lysophosphatidic acid-ME399948--1.716Reference-1474
Phloroglucinol-ME399956--8.359Reference-2546
Υ-Aminobutyric acid (GABA)-ME399986--7.809Reference-796


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