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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
11-amino-undecanoic acid11-Aminoundecanoic acidME637133-C193257.503438658-
1,6,8-trimethylallantoate-ME637130--23.64222616-
1-Methylhistidine1-MethylhistidineME637203-C0115212.09771787-
1-Methylhypoxanthine1-MethylhypoxanthineME637089--7.834146774-
(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol-ME637096--7.490269339-
1-(sn-Glycero-3-phospho)-myo-inositolsn-Glycero-3-phosphoinositolME637294-C0122516.18840532-
2,3-Diaminosalicylic acid2,3-Diaminosalicylic acidME637137--8.169284548-
2,7-Anhydro-alpha-N-acetylneuraminic acidN-Acetyl-2,7-anhydro-alpha-neuraminic acidME637083-C0452113.90721247-
2-Amino-2-methylbutanoate-ME637259-C0357110.91456942-
2-Amino-5-(methylthio)pentanoic acidHomomethionineME637044-C1721316.60347047-
2-Aminoheptanoate2-Aminoheptanoic acidME637045--12.90491769-
2-Butenyl-4-methyl-threonine2-Butenyl-4-methylthreonineME637264-C120297.50542363-
2-HexenoylcarnitineCAR 6:1ME637134--9.549563126-
2-{[hydroxy(4-hydroxy-3,5-dimethoxyphenyl)methylid...-ME637123--12.75206252-
2'-hydroxypyridoxol-ME637125--9.384358906-
2-Keto-6-aminocaproate2-Keto-6-aminocaproateME637210-C032397.487938054-
2-MethylbutyroylcarnitineCAR 4:0;2MeME637116--7.501602732-
2-Methylbutyrylglycine2-MethylbutyrylglycineME637258--5.666080947-
2-methylhistamine-ME637126-C1792821.329715-
2-methylphosphinoyl-2-hydroxyacetate-ME637142--15.29999941-
2-Oxoarginine2-OxoarginineME637046-C0377114.25802078-
3,4,5-trihydroxy-6-[(3-methoxy-3-oxopropanoyl)oxy]...-ME637265--10.15050823-
3-amino-octanoic acid3-Aminooctanoic acidME637151--14.85263062-
(3-Arylcarbonyl)-alanine-ME637272-C034507.479834529-
3-Butynoate3-Butynoic acidME637051-C0614410.50508325-
3-(Cystein-S-yl)acetaminophen3-(Cystein-S-yl)acetaminophenME637084--7.789283916-
3-Dehydrocarnitine3-DehydrocarnitineME637146-C026367.494182808-
3-Hydroxyanthranilic acid3-Hydroxyanthranilic acidME637080-C006329.213994744-
3-hydroxy-cis-5-octenoylcarnitine-ME637257--5.639926202-
3-hydroxy-cis-5-octenoylcarnitine_1-ME637279--7.455956523-
3-hydroxydecanoyl carnitineCAR 10:0;3OHME637106--7.481598786-
3-Methoxyanthranilate3-Methoxyanthranilic acidME637079-C058317.494666071-
3-MethylglutarylcarnitineCAR DC5:0;3MeME637143--11.97869513-
3-Methylguanine3-MethylguanineME637277-C022309.545139749-
3-nitro-2-pentanol-ME637085--7.811505389-
3-Oxohexobarbital3-OxohexobarbitalME637284-C025177.484670221-
3-Pyridinebutanoic acid-ME637174--11.39500827-
{[-4-(5-hydroxy-1-oxo-1H-isochromen-3-yl)but-3-en-...-ME637094--8.112191663-
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME637047-C029469.14400323-
4-Hydroxyphenylacetaldehyde-oxime-ME637081-C04350_C043537.497611245-
4-Imidazolone-5-propionic acid4-Imidazolone-5-propionic acidME637204-C0368011.51270425-
4-(Trimethylammonio)but-2-enoate(E)-4-(Trimethylammonio)but-2-enoateME637144-C0411410.32227862-
5-Acetamidovalerate5-Acetamidovaleric acidME637066-C0308712.45372954-
5-Methyl-2'-deoxycytidine5-Methyl-2'-deoxycytidineME637145-C035929.077275558-
5-Methylcytosine5-MethylcytosineME637054-C023769.00469298-
5-Methylthioribose5-MethylthioriboseME637071-C030899.636948903-
6-[4-(5,7-dihydroxy-6-{4-hydroxy-6-methyl-5-oxo-3-...-ME637115--9.116153815-
6-Acetyl-1,2,3,4-tetrahydropyridine6-Acetyl-1,2,3,4-tetrahydropyridineME637131--18.99231718-
6-Amino-9H-purine-9-propanoic acid-ME637105--7.486829758-
6-Keto-decanoylcarnitineCAR 10:0;6oxoME637099--7.480339904-
8-Amino-7-oxononanoate8-Amino-7-oxononanoic acidME637050-C0109211.67143069-
AcetamidopropanalAcetamidopropanalME637296-C181707.674647309-
Acetone cyanohydrin2-Hydroxy-2-methylpropanenitrileME637170-C026597.502013963-
AcetylcarnitineCAR 2:0ME637218-C0257110.5044755-
Acetyldihydrolipoamide-ME637147-C011367.595397186-
AdenineAdenineME637241-C001479.117526803-
AdenosineAdenosineME637247-C002128.731774975-
Adenosine monophosphateAMPME637223-D06299_C0002013.62966425-
Ala/Ala/Phe/His/Lys-ME637139--9.858550741-
AlanineAlanineME637069-C00041_C0013314.80896396-
Ala/SerAla-SerME637176--21.57073197-
AllysineAllysineME637067-C01475_C0407613.0749285-
AloinAloinME637295-C103057.490208287-
alpha-D-desosamine-ME637128--13.60727872-
alpha-D-desosamine_1-ME637135--10.69516667-
(alpha-keto-dimethyl-delta-N,N-Dimethylguanidynol)...-ME637281--10.61644578-
Aminoadipic acidAminoadipic acidME637196-C0095614.99816022-
Arg/Asp/Gly/Ser-ME637152--22.31473817-
ArginineArginineME637228-C00792_C0006223.64274738-
Arg-OEtEthyl arginateME637269-C0140420.90870826-
AsparagineAsparagineME637207-C00152_C0190515.42960481-
Aspartate-semialdehydeAspartate-semialdehydeME637201-C0044110.31382039-
Aspartic acidAspartic acidME637225-C00402_C0004915.24083223-
Asp/Cys/Cys/Ser-ME637285--17.00618327-
BendiocarbBendiocarbME637255-C144338.319072669-
Benzimidazole1H-BenzimidazoleME637103-C020097.495505923-
beta-Alanyl-L-lysine-ME637049-C0534121.09969046-
beta-aspartyl-L-alanine-ME637274--15.32984754-
BotrydialBotrydialME637291-C096227.46288923-
ButyrylcarnitineCAR 4:0ME637288-C028628.170640196-
C36-phenolphthiodiolenone A-ME637267--3.188501803-
CantleyineCantleyineME637260-C099334.629213079-
CAPS-ME637256--8.872830627-
Carnitinamide-ME637097-C0229019.63800541-
CarnitineCarnitineME637248-C00318_C0048712.95656459-
CarnosineCarnosineME637252-C0038615.50594526-
Cholic acidCholic acidME637287-C006957.476588694-
Citric acidCitric acidME637217-C0015818.55440871-
CitrullineCitrullineME637230-C0032715.86229942-
clomethiazole-ME637098--10.28310319-
Cotinine glucuronide-ME637173--17.85195247-
CreatineCreatineME637227-C0030014.5548983-
CreatinineCreatinineME637181-C007919.525572516-
CyclopentanoneCyclopentanoneME637101-C005577.493852361-
CystathionineCystathionineME637184-C02291_C0054217.08880343-
Cysteine-S-sulfateCysteine-S-sulfateME637185-C0582418.02779156-
CystineCystineME637186-C01420_C0049116.36948031-
CytidineCytidineME637189-C02961_C0047511.832606-
dansyl chloride-ME637082--7.494483307-
D,D-diaminopimelate-ME637065-C0068022.31303595-
DecanoylcarnitineCAR 10:0ME637159-C032997.464627983-
DeoxycytidineDeoxycytidineME637245-C0088110.2049012-
DeoxyinosineDeoxyinosineME637242-C055128.518453604-
DeoxyuridineDeoxyuridineME637246-C005268.115777388-
Diacetylmonoxime2,3-Butanedione monoximeME637087-C075098.175424687-
DiethanolamineDiethanolamineME637058-C0677218.99107239-
Dihydrobiopterin4a-Carbinolamine tetrahydrobiopterinME637064-C02953_C0026812.36240227-
DihydrothymineDihydrothymineME637068-C0090614.69538604-
DihydrouracilDihydrouracilME637191-C004297.60122848-
DimethylglycineDimethylglycineME637075-C0102611.9917301-
DL-2-Aminooctanoic acid2-Aminocaprylic acidME637280--12.92986398-
DL-beta-hydroxynorvaline-ME637100--12.20465166-
DopamineDopamineME637053-C037587.510783304-
EctoineEctoineME637059-C0623112.71904353-
Epsilon-(gamma-Glutamyl)-lysineEpsilon-(gamma-Glutamyl)-lysineME637273--17.99847027-
ErgothioneineErgothioneineME637078-C0557014.91458152-
EthionineL-EthionineME637112-C1122712.43479445-
Europine-ME637108-C103019.981302092-
formylaminopyrimidine-ME637092--7.505151638-
gamma-Glutamyl-gamma-aminobutyraldehydegamma-Glutamyl-gamma-aminobutyraldehydeME637180-C157008.455308073-
gamma-Glutamylisoleucinegamma-GlutamylisoleucineME637124--14.09024702-
Glu/ArgGlu-ArgME637286--18.00592869-
Glu/LysGlu-LysME637153-C0470016.66406544-
Glutamate methylester-ME637270-C050169.848212884-
Glutamic acidGlutamic acidME637224-C00217_C00025_C0030214.89659104-
GlutamineGlutamineME637192-C00064_C0081915.03808062-
GlutarylcarnitineCAR DC5:0ME637138--12.53876957-
GlutathioneGlutathioneME637077-C02471_C0005119.71897612-
Gly/ArgGly-ArgME637155--17.01088086-
Glycerophosphocholinesn-Glycero-3-phosphocholineME637235-C0067014.03674832-
Guanidoacetic acidGuanidoacetic acidME637226-C0058115.93676369-
HeptanoylcarnitineCAR 7:0ME637090--7.480159175-
HexanoylcarnitineCAR 6:0ME637160--7.486694809-
Hippuric acidHippuric acidME637231-C015867.482538078-
HistidinalHistidinalME637060-C019297.745210217-
HistidineHistidineME637206-C06419_C0013514.4026129-
HomocarnosineHomocarnosineME637179-C0088413.89506146-
Homostachydrine(S)-HomostachydrineME637113-C082839.610842994-
HydroxybutyrylcarnitineCAR 4:0;OHME637140--10.77719697-
HydroxyhexanoycarnitineCAR 6:0;OHME637114--9.411031017-
hydroxyisovaleroyl carnitineCAR 4:0;OH,MeME637141--9.991042873-
HypoxanthineHypoxanthineME637074-C0026210.14760531-
Ile/AlaIle-AlaME637169--12.2474059-
Ile/Lys/ProIle-Lys-ProME637154--20.5976072-
Ile/ProIle-ProME637168--9.490804376-
Imidazoleacetic acidImidazoleacetic acidME637062-C0283511.86220423-
Imidazoleacetic acid ribosideImidazoleacetic acid ribosideME637061-C0513113.06876184-
IndospicineIndospicineME637107-C0828822.37872052-
InosineInosineME637244-C0029410.81002845-
IsoputreanineIsoputreanineME637120--18.12672572-
IsovalerylalanineIsovalerylalanineME637283--7.480832769-
jasmonoyl-1-aminocyclopropane-1 carboxylate-ME637086--7.49067549-
KynurenineKynurenineME637251-C0032810.57661191-
LentiginosineLentiginosineME637136-C1015514.73062098-
LeucineLeucineME637220-C16439_C00123_C0157010.51362465-
LotaustralinLotaustralinME637171-C0833412.72140292-
LysineLysineME637237-C00739_C0004722.31747863-
LysoPC(15:0)LPC 15:0ME637197-C042307.429188083-
LysoPC(16:0)LPC 16:0ME637232-C04102_C042307.42806847-
LysoPC(16:0)_1LPC 16:0ME637233-C04102_C042304.095539293-
LysoPC(18:0)LPC 18:0ME637057-C042303.910517865-
LysoPC(18:2)LPC 18:2ME637198-C04100_C042303.99791069-
LysoPC(20:4)LPC 20:4ME637056-C042307.402416629-
LysoPE(16:0)LPE 16:0ME637234--7.44721607-
LysoPE(18:2)LPE 18:2ME637199--7.443389874-
LysoPE(19:1)LPE 19:1ME637166--7.432477933-
LysoPE(21:0)LPE 21:0ME637165--7.393667257-
Lys/ValLys-ValME637156--21.49191655-
MannitolMannitolME637195-C00392_C0148913.9521981-
MetharbitalMetharbitalME637104--4.620516629-
MethionineMethionineME637193-C00073_C0173311.40443279-
Methionine sulfoxideMethionine sulfoxideME637239-C0298913.27781721-
methyl-CoMMethyl-CoMME637162-C039208.574079132-
Methylimidazoleacetic acidMethylimidazoleacetic acidME637063-C058289.396544575-
Myrtenic acid-ME637157-C14515_C03037_C119407.487620375-
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME637293-C058427.497093419-
N2-Fructopyranosylarginine-ME637253--17.20760135-
N2-gamma-Glutamylglutaminegamma-GlutamylglutamineME637276-C0528315.19169348-
N4-AcetylaminobutanalN4-AcetylaminobutanalME637048-C0593610.77937694-
N4-AcetylcytidineN4-AcetylcytidineME637093--8.072500574-
N6-Acetyl-L-lysineN6-AcetyllysineME637212-C0272712.42303205-
N6-Hydroxy-L-lysineN(6)-Hydroxy-lysineME637211-C0102821.38983314-
N(6)-MethyllysineN(6)-MethyllysineME637177-C0272821.77276894-
N6,N6,N6-Trimethyl-L-lysineN-6-TrimethyllysineME637052-C0379321.11668826-
N-Acetyl-beta-alanineN-Acetyl-beta-alanineME637182-C010739.410488596-
N-Acetylglutamic acidN-Acetylglutamic acidME637213-C0062414.44990227-
N-AcetylglutamineN-AcetylglutamineME637261--10.66290894-
N-AcetylhistidineN-AcetylhistidineME637282-C0299710.25278041-
N-acetyl-L-2-aminoadipate(2-)N-Acetyl-2-aminoadipic acidME637209-C1298613.86831847-
N-Acetyl-L-methionineN-AcetylmethionineME637129-C027127.480340467-
Nalpha-MethylhistidineN-MethylhistidineME637263-C0329812.76576309-
N-(butyryl)-L-homoserine-ME637275-C118437.483616057-
N-Desalkyl flurazepam-ME637127--11.62033205-
Ne,Ne dimethyllysineN(6),N(6)-Dimethyl-lysineME637254-C05545 _C0554520.83772415-
N-Formyl-L-methionineN-FormylmethionineME637222-C031457.488477943-
N-Hydroxy-2-acetamidofluorene-ME637158-C039548.208030955-
N-(hydroxydecanoyl)-L-serine-ME637118--8.518496003-
N-hydroxyisoleucineN-hydroxyisoleucineME637292--12.12444084-
N-hydroxy-N-acetylcadaverine-ME637132--16.19490701-
N,N'-Diacetylchitobiosyldiphosphodolichol-ME637122-C045379.897512403-
OctanoylcarnitineCAR 8:0ME637172-C028387.473308945-
O-PhosphoethanolaminePhosphoethanolamineME637219-C0034616.11671074-
OrnithineOrnithineME637229-C00077_C01602_C0051521.55751599-
OtonecineOtonecineME637262-C1035610.71242837-
Otonecine_1OtonecineME637278-C103567.480723011-
Oxidized glutathioneOxidized glutathioneME637214-C0012717.31705962-
PA(30:3)PA 30:3ME637055--8.224369894-
Pantothenic acidPantothenic acidME637216-C008648.721355983-
PC(34:2)PC 34:2ME637073-C001573.340041401-
PC(36:2)PC 36:2ME637072-C001573.300733866-
PC(P-18:0)PC P-18:0ME637164--7.408436893-
PentanamidePentanamideME637161-C0184210.50682629-
PhenylalaninePhenylalanineME637194-C00079_C022659.898322587-
phenyl sulfoxide-ME637091--14.78290656-
Phe/ThrPhe-ThrME637167--10.00523395-
PI(38:4)PI 38:4ME637200-C006262.996541668-
PicolinamidePicolinamideME637290-C019507.503455328-
PirbuterolPirbuterolME637117-C0780712.33309887-
p-nitroso-N,N-dimethylaniline-ME637121--7.477510727-
Prenyl glucosidePhellamurinME637111-C0980820.95449415-
ProlineProlineME637205-C00148_C0076312.62965006-
Propanoyl phosphatePropanoyl phosphateME637238-C0287611.98038039-
PropionylcarnitineCAR 3:0ME637175-C030179.207994625-
PsicofuraninAngustmycin CME637119-C053429.756560925-
psicoselysinePsicosyllysineME637163--17.15131553-
psicoselysine_1PsicosyllysineME637289--20.52278488-
Pyroglutamic acidPyroglutamic acidME637178-C01879_C0223710.45702042-
Quinaldic acidQuinaldic acidME637102-C063257.487275823-
RacemethionineRacemethionineME637043-C00855_C017337.488451767-
RetronecineRetronecineME637148-C0617713.30103546-
RhexifolineRhexifolineME637266-C099867.477130363-
Ribose 5-phosphateRibose 5-phosphateME637240-C03736_C0011715.85327323-
Selenocysteine selenate-ME637076-C0570519.73993458-
SerineSerineME637070-C00740_C00065_C0071615.94382307-
SlaframineSlaframineME637149-C061859.37764023-
Sphinganine 1-phosphateSphinganine 1-phosphateME637298-C011207.492801158-
Sphingosine 1-phosphateSphingosine 1-phosphateME637297-C061247.49063926-
Swainsonine-ME637110-C1017311.49091075-
TarginineTarginineME637150-C0388422.09278572-
TaurineTaurineME637183-C0024515.49993272-
TaurocyamineTaurocyamineME637249-C0195916.07941368-
TaurohyocholateTaurohyocholic acidME637271-C155167.458161926-
TheanineN(5)-Ethyl-glutamineME637268-C0104713.20417502-
ThreonineThreonineME637208-C00188_C0082014.52442095-
ThymineThymineME637187-C001787.493771091-
trans-2-DodecenoylcarnitineCAR 12:1(2E)ME637088--7.45169397-
trans-2-Tetradecenoylcarnitinetrans-2-TetradecenoylcarnitineME637095--7.430810147-
TryptophanTryptophanME637250-C00525_C00806_C0007811.58819101-
TyrosineTyrosineME637236-C01536_C00082_C0642013.0921281-
UracilUracilME637188-C001068.495901621-
Ureidopropionic acidUreidopropionic acidME637215-C0264212.36640476-
UridineUridineME637190-C002999.839320192-
UrocanateUrocanic acidME637202-C007859.105019912-
ValineValineME637221-C00183_C16436_C0641712.25248328-
VigabatrinVigabatrinME637109-C075007.48617849-
XanthineXanthineME637243-C0038511.75040008-


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
10-keto myristic acid-ME637459--7.483960908-
11-bromo-undecanoic acid-ME637452--7.488040225-
12-HETE12-HETEME637352-C147773.43641777-
1-[(3-Carboxypropyl)amino]-1-deoxyfructose-ME637414--10.49531304-
1-Pentanesulfenothioic acid-ME637423--10.16490059-
2,3-Dihydroxycyclopentaneundecanoic acid-ME637426-C149874.18079883-
2,4-Dihydroxyacetophenone 5-sulfate-ME637438--18.91926204-
2,5-Dioxopentanoate-ME637310-C004337.487938054-
2-C-Methyl-D-erythritol 4-phosphate-ME637313-C1143414.64148563-
2-Hydroxycaproic acid2-Hydroxyhexanoic acidME637325--7.488086545-
2-Hydroxyethanesulfonate2-HydroxyethanesulfonateME637381-C0512311.53186362-
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME637346-C03196_C02630_C0108715.53088169-
2-Hydroxyhexadecanoic acid2-Hydroxypalmitic acidME637353--3.522429567-
2-isocapryloyl-hydroxymethyl-gamma-butyrolactone-ME637393--7.482132036-
2-Keto-glutaramic acid2-Keto-glutaramic acidME637347-C0094010.99663398-
2-Methyl-3-oxopropanoic acid-ME637299-C06002_C003497.503296227-
2-methyl-tridecanedioic acid2-Methyl-tridecanedioic acidME637327--7.479294059-
2-oxo-nonanoic acid-ME637322--7.483563446-
2-Pyridyl hydroxymethane sulfonic acid2-Pyridyl hydroxymethane sulfonic acidME637432-C113277.49658214-
(2R,4S)-2,4-Diaminopentanoate-ME637305-C0394323.61879568-
3-(2-Hydroxyphenyl)propanoic acid3-(2-Hydroxyphenyl)propanoic acidME637370-C011988.868096396-
3,3'-Thiobispropanoic acid3,3'-Thiobispropanoic acidME637442--7.862052409-
3-(4-Hydroxyphenyl)pyruvate4-Hydroxyphenylpyruvic acidME637304-C011798.524001149-
3-Dehydroquinate3-DehydroquinateME637356-C0094411.23901723-
3-hydroxy-3-methyl-2-oxobutanoate-ME637384-C041817.496403159-
3-Hydroxytetradecanedioic acid3-Hydroxy-tetradecanedioic acidME637402--7.47829814-
3-methyl-tetradecanedioic acid3-Methyl-tetradecanedioic acidME637323--7.47875061-
3-Oxodecanoic acid-ME637333--3.776264511-
3-Oxododecanoic acid3-Oxododecanoic acidME637466-C023673.631609774-
3-Oxooctadecanoic acid-ME637336--3.469937109-
3-Oxotetradecanoic acid3-Oxotetradecanoic acidME637465--3.517148817-
3-Phenyllactic acidPhenyllactic acidME637369-C01479_C056077.478752972-
4-Hydroxyhexan-3-one4-Hydroxyhexan-3-oneME637419-C029484.57721935-
4-hydroxytriazolam-ME637424--13.2158222-
5,6-Dihydrouridine5,6-DihydrouridineME637396--10.00631725-
5-Aminolevulinic acid5-Amino-levulinic acidME637357-C0043014.38410799-
5-Carboxy-2'-deoxyuridine-ME637446--8.126226189-
5-Hydroxypentanoic acid5-Hydroxyvaleric acidME637463-C028047.493961802-
5-Nonyltetrahydro-2-oxo-3-furancarboxylic acid-ME637405--4.631373178-
5-Nonyltetrahydro-2-oxo-3-furancarboxylic acid_1-ME637421--7.481456539-
6alpha-Hydroxycortisol-ME637420-C152917.470154051-
6-Methoxy-3-(2-thiazolyl)-1H-indole-ME637409--15.06164155-
9,10-DiHODE9,10-DiHODEME637359--3.887404455-
(9R,13R)-1a,1b-dihomo-jasmonic acid-ME637358--3.53656905-
Acetoacetic acidAcetoacetic acidME637302-C001648.892316691-
Adrenic acidAdrenic acidME637377-C165273.338635109-
Ala/Phe/Pro/Thr/Trp-ME637408--7.446699996-
AllantoinAllantoinME637373-C01551_C02348_C0235014.6642666-
alpha-Ketoisovaleric acidKetoisovaleric acidME637301-C001417.495054298-
alpha-Methylstyrene-ME637410-C143954.541676861-
a-L-threo-4-Hex-4-enopyranuronosyl-D-galacturonic ...-ME637363-C04733_C0611817.29205954-
ApiitolApiitolME637422-C0156910.32876376-
arabino-1,4-lactone 5-phosphate-ME637385--15.0180999-
ArabinonateArabinonic acidME637364-C05411_C00545_C00878_C01685_C05412_C0050213.97821329-
Arachidonic acidArachidonic acidME637379-C002193.393141379-
AscorbateVitamin CME637311-C0007215.13353785-
Ascorbate 2-sulfate-ME637427-C0281219.08636911-
Beta-Glycerophosphoric acidsn-Glycero-2-phosphateME637388-C0297914.01597079-
C17 Sphingosine-1-phosphateC17 Sphingosine 1-phosphateME637407--7.49009641-
Caffeic acid 3-sulfate-ME637429--20.55773221-
CHAPSCHAPSME637447-C113218.237653228-
Cholesterol sulfateCholesterol sulfateME637440-C180432.979650588-
CinnamoylglycineCinnamoylglycineME637406--5.623895535-
cis-Aconitic acidcis-Aconitic acidME637345-C0041718.44474996-
coelimycin P1-ME637392--15.07465897-
Cysteic acidCysteic acidME637316-C0050615.49011078-
DehydroascorbateL-Dehydroascorbic acidME637312-C054227.48955772-
dihydroartemisinic acid hydroperoxide-ME637454--4.602754756-
dihydroartemisinic acid hydroperoxide_1-ME637455--7.479832731-
Dihydronaringenin-O-sulphate-ME637400--9.618405448-
Docosahexaenoic acidDocosahexaenoic acidME637470-C064293.345261834-
Eicosenoic acidEicosenoic acidME637332-C165263.33143226-
Epicatechin sulfate-ME637451--7.486462453-
Erythronic acidErythronic acidME637307-C0162017.16272983-
Erythronic acid_1Erythronic acidME637308-C0162013.28004463-
ErythruloseErythruloseME637350-C02022_C0204512.12087415-
Ethyl -3-hydroxyhexanoate-ME637467-C03864_C038657.49151718-
Ethyl 7-epi-12-hydroxyjasmonate glucoside-ME637403--7.480288282-
Ethyl beta-D-glucopyranoside-ME637448--8.925683339-
Ethylene brassylate-ME637411--7.47929346-
FA (18:2)Octadecadienoic acidME637331--3.394218273-
FA (18:3)Octadecatrienoic acidME637330--3.414541396-
FA methyl(16:1)-ME637326--3.387804265-
FA methyl(8:0)-ME637329--3.802808068-
FA oxo(14:2) cyclopentanebutanoic acid-ME637360--3.539808328-
FructoseFructoseME637343-C00095_C00795_C0233617.34285091-
Galactaric acidGalactaric acidME637306-C00879_C01807_C00818_C0135716.67810945-
Galactonic acidGalactonic acidME637366-C15930_C00800_C00257_C00880_C00770_C0051413.98757684-
Gallicynoic acid A-ME637401--7.476892992-
Gallicynoic acid A_1-ME637412--4.620518967-
Gallicynoic acid H-ME637431--7.47875299-
Gallicynoic acid H_1-ME637449--4.375510733-
Garcinia acidGarcinia acidME637391--17.15932152-
Gentianamine-ME637399-C099614.617909336-
Glu/Asp/PheGlu-Asp-PheME637469--9.872076198-
Gluconic acidGluconic acidME637367-C00257_C00880_C15930_C00800_C00817_C00770_C0051414.78120644-
GlucoseGlucoseME637319-C00738_C00031_C00267_C01662_C01381_C0022115.09067268-
Glucuronic acidGlucuronic acidME637365-C0019116.70286135-
Glucurono-6,3-lactone-ME637309-C0267018.64424189-
GlycerolGlycerolME637320-C0011610.3955634-
Glycerol 3-phosphatesn-Glycero-3-phosphateME637372-C00623_C0009315.15792412-
Glycerophosphoglycerolsn-Glycero-3-phosphoglycerolME637444-C0327412.94095241-
Heptadecanoic acidMargaric acidME637378--3.386792484-
Heptadecenedioic acidHeptadecenedioic acidME637389--7.473343422-
His/Lys/Lys/Met/Ser-ME637418--3.854959515-
HpOTrEHpOTrEME637471-C16321_C047854.027600016-
Hydroxyphenyllactic acidHydroxyphenyllactic acidME637383-C03672_C039649.49281064-
indole-3-acetonitrile oxide-ME637394--7.482538078-
Indolelactic acidIndolelactic acidME637382-C020438.376531528-
IndolepyruvateIndolepyruvateME637354-C003317.49117973-
Indoxyl sulfateIndoxyl sulfateME637434--8.877089945-
Inulicin-ME637397-C094837.480375581-
Kamahine C-ME637387--7.484152948-
KetoleucineKetoleucineME637300-C002334.608091408-
Lactapiperanol C-ME637417--7.477672631-
LysoPA(16:0)LPA 16:0ME637314-C00416_C040367.422679175-
LysoPE(16:0)LPE 16:0ME637371--4.117648824-
Malic acidMalic acidME637351-C00149_C03668_C0049716.52384676-
methyl 8-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclo...-ME637462--4.517404839-
Monoglyceride citrateMonoglyceride citrateME637441--11.59096305-
Monomethyl sulfateMethyl sulfateME637390-C027049.350270262-
Myristic acidMyristic acidME637321-C064243.471455383-
N-AcetylanthranilateMethyl n-acetylanthranilateME637415-C063325.558655294-
N-acetyl -D- glucosaminitolN-Acetyl-glucosaminitolME637439--12.95075531-
N-Acetyl-L-aspartic acidN-Acetylaspartic acidME637303-C0104214.89297713-
NereistoxinNereistoxinME637450-C1147415.53148873-
N-lactoyl-Methionine-ME637386--7.480100674-
O-AcetylserineO-AcetylserineME637317-C0097910.99500954-
octadecenoic acidOctadecenoic acidME637328--3.378032761-
Orange I-ME637425--9.834869494-
Orotic acidOrotic acidME637349-C0029510.71929103-
Oxoadipic acidOxoadipic acidME637338-C0032215.27933224-
Oxoglutaric acid2-Oxoglutaric acidME637361-C0002616.17908507-
Palmitic acidPalmitic acidME637348-C002493.410809663-
Palmitoleic acidPalmitoleic acidME637376-C083623.427459151-
p-Cresol glucuronideP-Cresol glucuronideME637443--8.015355095-
Phenethyl rutinoside-ME637428--7.483074424-
PhytuberinPhytuberinME637436-C097093.534865545-
PI(36:2)PI 36:2ME637341-C006262.999993451-
PI(36:4)PI 36:4ME637340-C006263.001071449-
PI(38:5)PI 38:5ME637342-C006262.999995822-
PI(40:7)PI 40:7ME637468--2.978429776-
Pipecolic acidPipecolic acidME637339-C0040812.23269573-
PKOOA-PE-ME637445--3.927795229-
Polypropylene glycol (m w 1,200-3,000)-ME637430--7.495424168-
PseudouridinePseudouridineME637375-C0206712.00714932-
RhamnoseRhamnoseME637337-C00507_C02338_C02476_C0252212.04325354-
SaccharinSaccharinME637472-D01085_C122837.252012897-
Salsoline-1-carboxylate-ME637395--7.478749411-
Sarcinic acid-ME637324-C166653.448990319-
Sebacic acidSebacic acidME637460-C082775.685110128-
Sebacic acid_1Sebacic acidME637461-C082777.481456539-
Sphingosine 1-phosphate (d16:1-P)-ME637473--7.491180347-
Stearic acidStearic acidME637355-C015303.360073114-
Succinic acidSuccinic acidME637362-C0004215.56241563-
SulfoacetateSulfoacetic acidME637380-C1417918.95521503-
sulfoglutathione-ME637437--19.70409132-
Swietenidin B-ME637433-C107417.480810353-
Taurodeoxycholic acidTaurodeoxycholic acidME637315-C054633.872761899-
Tetradecanedioic acidTetradecanedioic acidME637464-C110024.61571252-
TetrahydrocortisoneTetrahydrocortisoneME637453-C054704.112366665-
Tetranor-PGE1Tetranor-PGE1ME637458--7.482532174-
Thienodihydropyridinium-ME637435--17.05272028-
Tolylacetonitrile-ME637404-C025967.49064282-
trans-Aconitic acidtrans-Aconitic acidME637344-C02341_C0041719.71712508-
trans-Dodec-2-enoic acid2E-Dodecenoyl-CoAME637335--3.589848887-
trans-Tetra-dec-2-enoic acid-ME637334--3.511721506-
Trifluoroacetic acid-ME637413--4.625110241-
Trimetaphosphoric acid-ME637374-C0246621.71489245-
Tylactone-ME637457-C120007.477731493-
Tyrosol 4-sulfateCoenzyme Q9ME637398--7.485778518-
Uric acidUric acidME637318-C0036613.20369346-
Ursodeoxycholic acidUrsodeoxycholic acidME637456-C078807.452884454-
xi-gamma-Undecalactonegamma-UndecalactoneME637416-C085713.706738741-
XyloseXyloseME637368-C02205_C00181_C01510_C0209610.6121626-


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