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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Clausarinol-ME866089----
3-Hydroxyibuprofen-ME866090----
2,2-Dimethyl-5-hydroxy-1-pyrrolidinyloxy-ME866091----
Thr PheThr-PheME866092----
2-Phenylethanol glucuronide-ME866093----
Val IleVal-IleME866094----
Epsilon-CaprolactamEpsilon-caprolactamME866095----
4-Hydroxyquinoline4-HydroxyquinolineME866096----
PhenylacetylglycinePhenylacetylglycineME866097----
HistidylglutamineHis-GlnME866098----
Gamma-Glu-leugamma-GlutamylleucineME866099----
Ile IleIle-IleME866100----
CeruleninCeruleninME866101----
ClavulanateClavulanateME866102----
LeucylleucineLeu-LeuME866103----
3-Amino-1,4-dimethyl-5H-pyrido[4,3-b]indole-ME866104----
Momorcharaside B-ME866105----
DL-p-Chlorophenylalanine methyl ester hydrochlorid...-ME866106----
Ile PheIle-PheME866107----
Carotol-ME866108----
Parasorbic acid-ME866109----
Beta-Thujaplicin-ME866110----
Phe IlePhe-IleME866111----
Momordicoside C-ME866112----
MexiletineMexiletineME866113----
VomifoliolVomifoliolME866114----
DL-4-Hydroxyphenyllactic AcidHydroxyphenyllactic acidME866115----
Xenognosin A-ME866116----
Crotetamide-ME866117----
DG(8:0/a-17:0/0:0)-ME866118----
Ruscogenin-ME866119----
13(S)-Hydroperoxylinolenic acid13S-HpOTrEME866120----
(3beta,5alpha,6beta,9alpha,22E,24R)-23-Methylergos...-ME866121----
1-Pentanol1-PentanolME866122----
N-(1-Hydroxypropan-2-yl)icosa-5,8,11,14-tetraenami...-ME866123----
Fasciculic Acid B-ME866124----
Germacrene DGermacrene DME866125----
Fasciculol C-ME866126----
Ginsenoside Re3-MethyluridineME866127----
DalfopristinDalfopristinME866128----
AcetylisoniazidAcetylisoniazidME866129----
6-deoxoteasterone6-DeoxoteasteroneME866130----
Dihydrotachysterol-ME866131----
Jacarandic acid-ME866132----
6-Dehydrotestosterone glucuronide-ME866133----
Linalyl propionate-ME866134----
15-Deoxyprostaglandin J2-ME866135----
1-Methyl-1,3-cyclohexadiene-ME866136----
Dihydroconiferyl alcohol-ME866137----
LysoPA(a-21:0/0:0)-ME866138----
Maniladiol-ME866139----
Milbemycin beta2-ME866140----
Cnidilide-ME866141----
5-Megastigmen-7-yne-3,9-diol 3-glucoside-ME866142----
Gibberellin A19-ME866143----
Schizandrin-ME866144----
DoxazosinDoxazosinME866145----
2(5H)-Furanone4-Hydroxy-2-butenoic acid gamma-lactoneME866146----
22-Angeloylbarringtogenol C-ME866147----
RimantadineRimantadineME866148----
N,N-Dimethyldodecylamine-N-oxideN,N-Dimethyldodecylamine N-oxideME866149----
16-Hydroxyhexadecanoic acidJuniperic acidME866150----
Soyasapogenol B 24-O-b-D-glucoside-ME866151----
4alpha-Methylzymosterol4alpha-MethylzymosterolME866152----
PinolidoxinPinolidoxinME866153----
CarvoneCarvoneME866154----
Sanchinoside B1-ME866155----
BenzeneacetonitrileBenzeneacetonitrileME866156----
(Z)-4-Hydroxy-6-dodecenoic acid lactone-ME866157----
Alpha-Ironealpha-IroneME866158----
Tanacetol A-ME866159----
12S-HHT12S-HHTrEME866160----
Ecklonialactone A-ME866161----
Melledonal A-ME866162----
Dihydrojasmonic acid-ME866163----
Brassidic acid-ME866164----
Soyasapogenol BSoyasapogenol BME866165----
4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol4alpha-Carboxy-4beta-methyl-zymosterolME866166----
Gliocladic Acid-ME866167----
2,5-Heptadien-1-ol-ME866168----
Hexadeca-7,10,13-trienoic acid-ME866169----
Delta-CEHC-ME866170----
Soyasapogenol C-ME866171----
Risbitin-ME866172----
5-(6-hydroxy-6-methyloctyl)furan-2(5H)-one-ME866173----
Gibberellin A8-cataboliteGibberellin A8-cataboliteME866174----
Proazulene-ME866175----
Spirolide E-ME866176----
Eremopetasidione-ME866177----
9-Hydroxylinoleic acidDimorphecolic acidME866178----
17-Hydroxylinolenic acid-ME866179----
Manoalide-ME866180----
Ursolic acidUrsolic acidME866181----
PA(TXB2/20:3(8Z,11Z,14Z))-ME866182----
SterolTriethanolamineME866183----
KAPAAcetoacetic acidME866184----
9-Tetradecenoic acidMyristoleic acidME866185----
5,6-Epoxy-8,11,14-eicosatrienoic acid-ME866186----
Isopentyl beta-D-glucoside-ME866187----
Isoketocamphoric acid-ME866188----
N'-nitrosonornicotineN'-NitrosonornicotineME866189----
8-Amino-7-oxononanoic acid8-Amino-7-oxononanoic acidME866190----
Caprylic acidCaprylic acidME866191----
4-[(2R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxol...-ME866192----
Cyclooctyne-ME866193----
Eicosapentaenoic acidEicosapentaenoic acidME866194----
9,10-Epoxystearic acid9,10-Epoxystearic acidME866195----
Oleic acidOleic acidME866196----
Deoxycholylarginine-ME866197----
D-(+)-dihydrocarvone-ME866198----
Homodihydrojasmone-ME866199----
Xyloketal-ME866200----
(3S,5R,6R,7E)-3,5,6-Trihydroxy-7-megastigmen-9-one-ME866201----
Andrographolide-ME866202----
Isolubimin-ME866203----
Alpha-Terpineol propanoate-ME866204----
(E)-6,10-Dimethyl-9-methylene-5-undecen-2-one-ME866205----
Prostaglandin A2PGA2ME866206----
(Z)-Farnesol-ME866207----
5(S)-Hydroperoxyeicosatetraenoic acid5S-HpETEME866208----
Daucol-ME866209----
Alpha-Cyperol-ME866210----
LysoSM(d18:1)Sphingosine-1-phosphocholineME866211----
3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4a...3-beta-Hydroxy-4-beta-methyl-5-alpha-cholest-7-ene-4-alpha-carboxylateME866212----
Actein-ME866213----
PA(20:3(8Z,11Z,14Z)/15:0)PA 20:3(8Z,11Z,14Z)/15:0*ME866214----
5-KETE5-Oxo-ETEME866215----
Typhasterol-ME866216----
CyclohexaneCyclohexaneME866217----
Butylisopropylamine-ME866218----
OctylamineOctylamineME866219----
PiperidinePiperidineME866220----
P-CHLOROPHENYLALANINE-ME866221----
PS(22:2(13Z,16Z)/15:0)PS 22:2(13Z,16Z)/15:0*ME866222----
3-Iodoprop-2-yn-1-yl Butylcarbamate-ME866223----
5'-Deoxy-5-fluorouridine-ME866224----
Olpadronic acid-ME866225----
Palitantin, (+)--ME866226----
CidofovirCidofovirME866227----
Arkofix-ME866228----
FagomineFagomineME866229----
3-Ketosphingosine3-KetosphingosineME866230----
12-Hydroxy-8,10-octadecadienoic acid-ME866231----
Cucurbic acidCucurbic acidME866232----
7-Acetylintermedine-ME866233----
N-Docosahexaenoyl Asparagine-ME866234----
DG(8:0/20:4(5Z,8Z,11Z,14Z)-OH(17)/0:0)-ME866235----
Shikimic acidShikimic acidME866236----
All-trans-13,14-dihydroretinol-ME866237----
TebupirimfosTebupirimfosME866238----
Kioukasin A-ME866239----
4-Hydroxyretinoic acid-ME866240----
4-Vinylcyclohexene-ME866241----
Manoyl oxide-ME866242----
(Z)-3-Methyl-2-(2-pentenyl)-2-cyclopenten-1-one-ME866243----
NuatigeninNuatigeninME866244----
5-Hydroxy-3,3',4',7,8-pentamethoxyflavone-ME866245----
N-Stearoyl Valine-ME866246----
4,5-Dihydrovomifoliol-ME866247----
Cis-Quinceoxepane-ME866248----
P-Cymenep-CymeneME866249----
1,10-Epoxygermacrone-ME866250----
N-UndecanoylglycineNA-Gly 11:0ME866251----
Solutol HS 15-ME866252----
Glabric acid-ME866253----
Chenodeoxycholylserine-ME866254----
MG(i-24:0/0:0/0:0)-ME866255----
2-Hydroxy-4-oxo-5,12-heneicosadien-1-yl acetate-ME866256----
DG(i-14:0/PGJ2/0:0)-ME866257----
Dihydroceramide C2-ME866258----
13,16-Docosadienoic acid13,16-Docosadienoic acidME866259----
(Z)-9-Cycloheptadecen-1-one-ME866260----
Curdione-ME866261----
Dihydroceramide-ME866262----
4-(1,1,3,3-Tetramethylbutyl)-phenol-ME866263----
C2 PHYTOCERAMIDE-ME866264----
(S)-(-)-Perillyl alcohol-ME866265----
Neoliquiritin 2''-apioside-ME866266----
D-Gal alpha 1->6D-Gal alpha 1->6D-Glucose-ME866267----
PS(18:1(9Z)/15:0)PS 18:1(9Z)/15:0*ME866268----
Pubesenolide-ME866269----
DG(16:1(9Z)/14:1(9Z)/0:0)DG 16:1(9Z)/14:1(9Z)/0:0*ME866270----
DodecanolDodecanolME866271----
Gonal-ME866272----
Soyasapogenol F-ME866273----
Ginsenoside C-K-ME866274----
1,25-Dihydroxy-19-norvitamin D3-ME866275----
Alpha-curcumene-ME866276----
TridihexethylTridihexethylME866277----
4-Ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-tr...-ME866278----
Tetraethylene Glycol Monododecyl Ether-ME866279----
Pentaethylene glycolPentaethylene glycolME866280----
2-Amino-3-cyclohexylpropanoic acid-ME866281----
25(R)-Hydroxyprotopanaxadiol-ME866282----
Alpha-Terpineol acetate-ME866283----
Mogrol-ME866284----
Cholylsarcosine-ME866285----
Cetyl recinoleate-ME866286----
Myristoleic acidMyristoleic acidME866287----
Ascorbyl stearate-ME866288----
6-Deoxocastasterone6-DeoxocastasteroneME866289----
1-[2-(4-fluorophenyl)pyrimidin-4-yl]-N-(3-methylbu...-ME866290----
Annonacin-ME866291----
OleamideOleamideME866292----
(13E)-11a-Hydroxy-9,15-dioxoprost-13-enoic acid-ME866293----
9,12,13-TriHOME9,12,13-TriHOMEME866294----
Ginsenoside Rg3-ME866295----
(2S,3S)-3-Decyl-2-Hydroxy-2-(3-Methoxy-3-oxopropyl...-ME866296----
Cafestol-ME866297----
Resolvin E1Resolvin E1ME866298----
FAHFA(16:0/10-O-18:0)-ME866299----
Pyroglutamic AcidPyroglutamic acidME866300----
N,n-Bis(2-hydroxyethyl)dodecanamideLauroyl diethanolamideME866301----
2-Keto-6-acetamidocaproate2-Keto-6-acetamidocaproic acidME866302----
PG(i-12:0/20:4(5Z,8Z,11Z,14Z)-OH(18R))-ME866303----
Epothilone DEpothilone DME866304----
Capsidiol-ME866305----
(20R)-Ginsenoside Rh2-ME866306----
Betulin-ME866307----
4,4alpha,5,6-Tetrahydro-7-methyl-2(3H)-naphthaleno...-ME866308----
1,2,3,4-TetrahydronaphthaleneTetralinME866309----
Dehydrocurdione-ME866310----
Protopanaxatriol-ME866311----
Camelliagenin C-ME866312----
Ursodeoxycholic acidUrsodeoxycholic acidME866313----
HypoxanthineHypoxanthineME866314----
(5xi,9xi,13xi,18xi,19beta)-3-Oxolup-20(29)-en-28-o...-ME866315----
UracilUracilME866316----
2-(Octadecyloxy)ethanol-ME866317----
Kanzonol O-ME866318----
2-Hydroxyadenine2-HydroxyadenineME866319----
Zearalanone-ME866320----
Phenylacetic acidPhenylacetic acidME866321----
Behenic acidBehenic acidME866322----
Alpha-Bisabolol oxide B-ME866323----
NILOTICIN-ME866324----
20-Carboxy-leukotriene B420-Carboxy-LTB4ME866325----
CinnamaldehydeCinnamaldehydeME866326----
Daunosamine-ME866327----
4-Hydroxynonenal4-HydroxynonenalME866328----
M-Xylenem-XyleneME866329----
Estradiol-17alpha 3-D-glucuronoside-ME866330----
Rubschisandrin-ME866331----
GuanosineGuanosineME866332----
9(S)-HODE9S-HODEME866333----
Ginsenoside Rh3-ME866334----
4-oxo-Retinoic acid-ME866335----
Notoginsenoside K-ME866336----
D6-Ambrettolide-ME866337----
(3E,5E)-1,3,5-octatriene-ME866338----
(2alpha,3beta)-20(29)-Lupene-2,3,28-triol-ME866339----
Jasmolone-ME866340----
Polyoxyethylene 40 monostearate-ME866341----
(+/-)7-epi Jasmonic Acid-ME866342----
12-oxo-PDA12-OPDAME866343----
DiethyltoluamideN,N-Diethyl-m-toluamideME866344----
Cinncassiol C2-ME866345----
(S)-Mandelic acid O-beta-D-Glucopyranoside-ME866346----
2-n-Propyl-4-oxopentanoic acid-ME866347----
15-keto-PGE115-Keto-PGE1ME866348----
2,4,4-Trimethylcyclopentanone-ME866349----
2-trans-6-cis-Dodecadienal-ME866350----
Glycyrrhetinic acidGlycyrrhetinic acidME866351----
Coniferyl alcoholConiferyl alcoholME866352----
Cyperolone-ME866353----
Glucomannan-ME866354----
Ginsenoside Rg5-ME866355----
Furfural2-FurancarboxaldehydeME866356----
3a,6b,7a,12a-Tetrahydroxy-5b-cholanoic acid3alpha,6beta,7alpha,12alpha-Tetrahydroxy-5beta-cholan-24-oic acidME866357----
4-O,6-O-Benzylidene-alpha-D-glucopyranose-ME866358----
CoumarinCoumarinME866359----
Ligustroside-ME866360----
4-[[4-[(1-propylsulfonylpiperidin-4-yl)methyl]phen...-ME866361----
Indoleacrylic acidIndoleacrylic acidME866362----
2-Pentyl-3-phenyl-2-propenal-ME866363----
Alisol A-ME866364----
Myristic acidMyristic acidME866365----
DesogestrelDesogestrelME866366----
Momordicoside D-ME866367----
12(S)-HETrE12S-HETrEME866368----
Citreoviridinol A1-ME866369----
Quinquenoside F1-ME866370----
N,N-DimethylsphingosineN,N-DimethylsphingosineME866371----
3,4-Dimethyl-5-pentyl-2-furanpropanoic acid-ME866372----
Polyethylene, oxidized-ME866373----
Secalciferol-ME866374----
IbuprofenIbuprofenME866375----
Isokobusone-ME866376----
Oleanolic aldehyde-ME866377----
Cis-Dihydrocarvone-ME866378----
LactitolLactitolME866379----
Pentamethylchromanol-ME866380----
Lappaol C-ME866381----
Barringtogenol CTheasapogenol BME866382----
Traumatic acidTraumatic acidME866383----
TraumatinTraumatinME866384----
ConiferaldehydeConiferyl aldehydeME866385----
Betulinic acidBetulinic acidME866386----
ButyrylcarnitineCAR 4:0ME866387----
Notoginsenoside R9-ME866388----
(R)-3-Hydroxy-5-phenylpentanoic acid-ME866389----
1-Naphthol1-NaphtholME866390----
Ethyl 3-hydroxydodecanoate-ME866391----
Cinnamyl acetate-ME866392----
Alpha-Elemolic acid-ME866393----
Tetracosahexaenoic acid, n-3-ME866394----
CarteololCarteololME866395----
DopamineDopamineME866396----
Epoxyeremopetasinorol-ME866397----
Ornidazole-ME866398----
Etiracetam-ME866399----
Cyclo(L-Phe-L-Pro)-ME866400----
CuminaldehydeCuminaldehydeME866401----
Matricin-ME866402----
GlycylleucineGly-LeuME866403----
FluocinoloneFluocinoloneME866404----
Majoroside F1-ME866405----
Decyl alcohol-ME866406----
ANETHOLEtrans-AnetholeME866407----
NX2 Toxin-ME866408----
Carbamothioic acid, diethyl--ME866409----
Momorcharaside A-ME866410----
Ginsenoside Rh7-ME866411----
PutrescinePutrescineME866412----
OrcinolOrcinolME866413----
4-Piperidinone, 1-hydroxy-2,2,6,6-tetramethyl--ME866414----
Epinepetalactone-ME866415----
IsoleucylprolineIle-ProME866416----
2-Butyne-1,4-diolBut-2-yne-1,4-diolME866417----
Eugenol-ME866418----
5,6,7,8-tetrahydro-2-Naphthoic Acid-ME866419----
2-HexenoylcarnitineCAR 6:1ME866420----
LeucylprolineLeu-ProME866421----
Ile LeuIle-LeuME866422----
2-Hydroxypent-3-enenitrile-ME866423----
Bafilomycin A1(Baf-A1)-ME866424----
2-Phenylacetamide2-PhenylacetamideME866425----
Eremopetasinorol-ME866426----
(+)-DehydrovomifoliolDehydrovomifoliolME866427----
Tetracosahexaenoic acidTetracosahexaenoic acidME866428----
VanilloylglycineVanilloylglycineME866429----
Swainsonine-ME866430----
Trans-p-Menthane-1,7,8-triol 8-glucoside-ME866431----
CHEBI:69439-ME866432----
3,4-dihydroxyphenylacetic Acid3,4-Dihydroxybenzeneacetic acidME866433----
(20E)-Ginsenoside F4-ME866434----
3alpha-Hydroxyoreadone3alpha-HydroxyoreadoneME866435----
Phe ValPhe-ValME866436----
Dibutylamine-ME866437----
Chlorobenzene-ME866438----
Psoralen-ME866439----
1-Methyl-2-PyrrolidinoneN-Methylpyrrolidin-2-oneME866440----
8-HydroxyquinolineQuinolin-8-olME866441----
3-ethylphenyl Sulfate-ME866442----
Val LeuVal-LeuME866443----
3-Methyl-3H-imidazo[4,5-f]quinolin-2-Amine-ME866444----
1-Carboxycyclohexaneacetic Acid-ME866445----
HistidylleucineHis-LeuME866446----
Glycyl-leucineGly-LeuME866447----
O-Toluidineo-ToluidineME866448----
Ala-LeuAla-LeuME866449----
Imidazolone A-ME866450----
Phe GlyPhe-GlyME866451----
S-(2-Carboxyethyl)-L-cysteine-ME866452----
P-Benzosemiquinone-ME866453----
ThymidineThymidineME866454----
LotaustralinLotaustralinME866455----
N-Methyl-2-pyrrolidinone2-PyrrolidinoneME866456----
3-Methylsuberic acid3-Methylsuberic acidME866457----
2-(3,7,11-Trimethyldodeca-2,6,10-trienylsulfanyl)b...-ME866458----
Val ValVal-ValME866459----
TrimethoprimTrimethoprimME866460----
PorphobilinogenPorphobilinogenME866461----
DihydrozeatinDihydrozeatinME866462----
9H-Purine-9-ol-ME866463----
Epigoitrin-ME866464----
L-TryptophanTryptophanME866465----
GuanineGuanineME866466----
L-GlutamineGlutamineME866467----
NorleucineNorleucineME866468----
VanillylamineVanillylamineME866469----
5-Hydroxy-2-imino-1-methylimidazolidin-4-one-ME866470----
4-Mercapto-ethyl-pyridine-ME866471----
Isocolumbin-ME866472----
AdenosineAdenosineME866473----
Cysteinylhydroxyproline-ME866474----
5'-Deoxyadenosine5'-DeoxyadenosineME866475----
Ile SerIle-SerME866476----
Epsilon-(Carboxymethyl)lysine-ME866477----
N2-Acetyl-L-ornithineN-AcetylornithineME866478----
PyridoxalPyridoxalME866479----
XanthineXanthineME866480----
NiacinamideNiacinamideME866481----
4-Guanidinobutanoic Acid4-Guanidinobutanoic acidME866482----
AdenineAdenineME866483----
6-Methyl-5,6-dihydro-4H-1,3-thiazin-2-amine-ME866484----
Dimethyl SulfoxideDimethyl sulfoxideME866485----
PyrrolinePyrrolineME866486----
5'-Phosphoribosyl-N-formylglycinamideFGARME866487----
GluconolactoneGluconolactoneME866488----
L-AsparagineAsparagineME866489----
Murrayenol-ME866490----
BiuretBiuretME866491----
Beta-D-ribosylnicotinateD-RibosylnicotinateME866492----
5-Hydroxyoct-2-enedioylcarnitine-ME866493----
Norrubrofusarin 6-beta-gentiobioside-ME866494----
WalleminoneWalleminoneME866495----
TrigonellineTrigonellineME866496----
Galactopinitol A-ME866497----
Aminocaproic acidAminocaproic acidME866498----
DehydrophytosphingosineDehydrophytosphingosineME866499----
Sinapic AcidSinapic acidME866500----
Cnp-maltotrioside-ME866501----
SucroseSucroseME866502----
BetaineBetaineME866503----
L-SerineSerineME866504----
3,5,5-Trimethyl-1,2-cyclohexanedione-ME866505----
N-Methyl-1-deoxynojirimycinN-Methyl-1-deoxynojirimycinME866506----
(R)-Apiumetin-ME866507----
PseudouridinePseudouridineME866508----
L-ThreonineThreonineME866509----
9(S)-HPODE9S-HpODEME866510----
3-Oxo-12,18-ursadien-28-oic acid-ME866511----
Beta-Cortolbeta-CortolME866512----
PA(a-15:0/PGF1alpha)-ME866513----
2-hydroxy-3-methyl-2-Cyclopenten-1-one-ME866514----
5-Methyl-2-furaldehyde-ME866515----
(S,S)-Butane-2,3-diol(S,S)-Butane-2,3-diolME866516----
Trans-2-Hexenal-ME866517----
1,2,5-Trihydroxypyrrole-3-sulfonic acid-ME866518----
MJDBISSP00000009-ME866519----
MJDBISSP00000001-ME866520----
MJDBISSP00000002-ME866521----
MG(0:0/18:1(12Z)-O(9S,10R)/0:0)-ME866522----
(3S,3'S,5R,5'R,6R)-3,6-Epoxy-5,6-dihydro-3',5,8'-t...-ME866523----
Alisol B-ME866524----
Oxymetholone-ME866525----
Arctiol-ME866526----
(3alphaOH,20S,24S)-3,19:20,24-Diepoxydammarane-3,2...-ME866527----
Palmitic amidePalmitamideME866528----
Ganodermic acid TQ-ME866529----
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanoneME866530----
4-Octylphenol4-OctylphenolME866531----
(+/-)-(Z)-2-(5-Tetradecenyl)cyclobutanone-ME866532----
2-Acetoxy-4-Pentadecylbenzoic Acid2-Acetoxy-4-pentadecyl-benzoic acidME866533----
OctadecanamideStearamideME866534----
2-(Diisopropylamino)ethanol-ME866535----
IsophoroneIsophoroneME866536----
StachyoseStachyoseME866537----
Longicamphenylone-ME866538----
Icofungipen-ME866539----
Dmap-ethyl-paf-ME866540----
PolidocanolPolidocanolME866541----
Sophoradiol-ME866542----
5-Hydroxycapsanthin-5,6-epoxide-ME866543----
Farnesyl acetone-ME866544----
Ginsenoside Rk1-ME866545----
Hovenine A-ME866546----
5alpha-Androst-1-en-3-one-ME866547----
Hebevinoside IV-ME866548----
Germacrone-ME866549----
Marrubiin-ME866550----
7a-Hydroxyandrost-4-ene-3,17-dione7a-Hydroxyandrost-4-ene-3,17-dioneME866551----
Schisantherin B-ME866552----
Tsugaric acid A 21-glucosyl ester-ME866553----
11-Oxohexadecanoic acid-ME866554----
Dillanol-ME866555----
Psilostachyin-ME866556----
Myotoxin A-ME866557----
Chavicol-ME866558----
Trans-EKODE-(E)-Ib-ME866559----
Isocyperol-ME866560----
P-Tolualdehyde-ME866561----
12-Ketodeoxycholic acid12-Ketolithocholic acidME866562----
LauryldiethanolamineN-LauryldiethanolamineME866563----
KievitoneKievitoneME866564----
2-Hydroxyacetophenone-ME866565----
1,25-Dihydroxy-16-ene-23-yne-vitamin D3-ME866566----
CajanolCajanolME866567----
1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadie...-ME866568----
Etaspirene-ME866569----
Vinylcyclohexene-ME866570----
Pantothenic AcidPantothenic acidME866571----
Mycorradicin-ME866572----
3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanat...-ME866573----
(3E,5Z)-3,5-Octadien-1-ol-ME866574----
3,5-Dihydroxy-6,7-megastigmadien-9-one-ME866575----
Soyasapogenol ESoyasapogenol EME866576----
3-(4-Hydroxy-3-methoxyphenyl)-2-methylpropionic ac...-ME866577----
(7-methoxy-1-benzofuran-2-yl)-[4-(2-pyrazol-1-ylet...-ME866578----
N-Palmitoyl Cysteine-ME866579----
2-Cyclopentene-1,4-dione-ME866580----
Helinorbisabone-ME866581----
3-O-(beta-D-Glucopyranosyl)-soyasapogenol B-ME866582----
IfosfamideIfosfamideME866583----
2-Aminobutan-1-ol-ME866584----
6,9,12,15,18,21-Tetracosahexaenoic acid-ME866585----
N-Acetyl-D-mannosamineN-Acetyl-mannosamineME866586----
MaltolMaltolME866587----
1,25-Dihydroxyvitamin D3-26,23-lactone-ME866588----
Euscaphic acid-ME866589----
Oleanolic AcidOleanolic acidME866590----
7alpha,17beta-Dihydroxyandrost-4-en-3-one-ME866591----
L-AlanineAlanineME866592----
Cyclopentanol-ME866593----
Schisandrin B-ME866594----
N-Methyl-D-Aspartic AcidN-Methyl-D-aspartic acidME866595----
Spirotaccagenin-ME866596----
Alpha,gamma-Onoceradienedione-ME866597----
L-CarnitineCarnitineME866598----
2-Amino-4-oxo-6-(1',2'-dioxoprolyl)-7,8-dihydroxyp...2-Amino-4-oxo-6-(1',2'-dioxoprolyl)-7,8-dihydroxypteridineME866599----
MethylguanidineMethylguanidineME866600----
Ethyl hydrogen fumarateEthyl hydrogen fumarateME866601----
13,16,19-Docosatrienoic acid13,16,19-Docosatrienoic acidME866602----
9,19-Cyclolanost-25-ene-3,24-diol-ME866603----
Trans-4-Aminocyclohexanecarboxylic acid-ME866604----
Sclareol oxide-ME866605----
5,6,8-Trihydroxy-2-methylbenzo[g]chromen-4-one-ME866606----
4-Hydroxymethylpyrazole-ME866607----
Alpha-Iononealpha-IononeME866608----
4-Amino-5-hydroxymethyl-2-methylpyrimidine4-Amino-5-hydroxymethyl-2-methylpyrimidineME866609----
Cycloart-23-ene-3beta,25-Diol-ME866610----
CytidineCytidineME866611----
Triisopropanolamine-ME866612----
2-Amino-2-methyl-1-propanol-ME866613----
Geranylcitronellol-ME866614----
CytosineCytosineME866615----
DihydrouracilDihydrouracilME866616----
NorvalineNorvalineME866617----
Desmethylmisonidazole-ME866618----
Cyclo(his-pro)Cyclo(His-Pro)ME866619----
DeoxycytidineDeoxycytidineME866620----
2-Hydroxypurine-ME866621----
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME866622----
2-Pyrrolidinone2-PyrrolidinoneME866623----
Acetolein-ME866624----
Ile AlaIle-AlaME866625----
4-Methyl-5-Thiazoleethanol5-(2-Hydroxyethyl)-4-methylthiazoleME866626----
3-Hydroxy-4-aminopyridine sulfate-ME866627----
1-Methyl-2-hydroadenosine-ME866628----
1-Isopropyl citrate-ME866629----
2-Phenyl-1,3-propanediol monocarbamate-ME866630----
Prenalterol-ME866631----
Metabolite B-ME866632----
DiethanolamineDiethanolamineME866633----
Ile ValIle-ValME866634----
XI-Dihydro-2-methyl-3(2H)-thiophenone-ME866635----
FasoracetamFasoracetamME866636----
Tuliposide ATuliposide AME866637----
4-Aminobutyraldehyde4-AminobutyraldehydeME866638----
5-HPETE5S-HpETEME866639----
Alpha-Muricholic Acidalpha-Muricholic acidME866640----
Cortisone acetateCortisone acetateME866641----
DehydrovomifoliolDehydrovomifoliolME866642----
DeoxyadenosineDeoxyadenosineME866643----
Enalaprilat-ME866644----
Ginsenoside Rg1-ME866645----
HexenalHexenalME866646----
IndoleIndoleME866647----
Indole-3-Carboxaldehyde1H-Indole-3-carboxaldehydeME866648----
LactoseLactoseME866649----
Lithocholic acidLithocholic acidME866650----
Methyl JasmonateMethyl jasmonateME866651----
N-Acetyl-D-galactosamineN-AcetylgalactosamineME866652----
N-Epsilon-Acetyl-L-Lysine-ME866653----
P-Coumaric Acidcis-p-Coumaric acidME866654----
StyreneStyreneME866655----
Trans-Cinnamic acidtrans-Cinnamic acidME866656----


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Sesamose-ME866657--0.6949701.1921
VerbascoseVerbascoseME866658--0.6949863.2458
RaffinoseRaffinoseME866659--0.7028539.1385
1-Kestose1-KestoseME866660--0.7028549.1674
L-PhenylalaninePhenylalanineME866661--2.5631164.0708
4-Oxoproline4-Oxo-prolineME866662--2.7942255.0619
ValylisoleucineVal-IleME866663--3.0448229.1553
Isoleucyl-AspartateIle-AspME866664--3.1323227.1032
ValylleucineVal-LeuME866665--3.2838229.1553
Ensulizole-ME866666--3.3718273.0338
KetoleucineKetoleucineME866667--3.5828129.0546
Deoxyloganic acid-ME866668--3.6124341.124
4-Methylbenzoic Acid4-Methylbenzoic acidME866669--4.6079135.0441
Dehydrocostus LactoneDehydrocostus lactoneME866670--4.8475211.113
Phenylpyruvic AcidPhenylpyruvic acidME866671--4.9035163.0392
Ethyl (S)-3-hydroxybutyrate glucoside-ME866672--5.1268275.1135
Indole-3-Carboxylic AcidIndole-3-carboxylic acidME866673--5.4658160.0395
2-Cyclohexen-1-one-ME866674--5.5778237.1128
4-Methoxycinnamic Acid4-Methoxycinnamic acidME866675--5.6338177.0548
N-(2-Hydroxy-3-methylbutanoyl)leucine-ME866676--5.7938230.1394
Dehydroandrographolide succinate-ME866677--5.8579553.2083
Abscisic AcidAbscisic acidME866678--5.8739263.1287
Monensin A-ME866679--5.8739715.4287
Cyclopentanecarboxylic acid-ME866680--5.9074227.1284
PI(16:0/16:1(9Z))PI 16:0/16:1(9Z)*ME866681--5.9674843.4767
12R-hydroxy-5Z,8Z,12Z-eicosatrienoic acid-ME866682--5.9735343.2237
Notoginsenoside T1-ME866683--6.0184697.4179
Hexadecyl ferulate-ME866684--6.0496463.3069
Elatoside G-ME866685--6.0496709.3818
Mukurozidiol-ME866686--6.0656315.0875
2'',4''-Bis-O-(4-hydroxycinnamoyl)astragalin-ME866687--6.0816739.1684
(R+)-3-(4-hydroxyphenyl)lactate-ME866688--6.1062162.0314
Xi-3-Methyl-3-cyclohexen-1-ol-ME866689--6.1062269.1757
Benzyl butyl phthalateBenzyl butyl phthalateME866690--6.1222357.1343
Aflatoxin B2-ME866691--6.1302335.0521
20-Carboxyleukotriene B420-Carboxy-LTB4ME866692--6.1622365.1971
Diethyl PhthalateDiethyl phthalateME866693--6.1869221.0814
[6]-Gingerdione-ME866694--6.1869337.1657
Isoprenyl alcohol-ME866695--6.1948217.144
3-hydroxypentadecanoic acid-ME866696--6.2029303.2176
Corchorifatty acid F-ME866697--6.2029327.2176
Ginsenoside Rh1-ME866698--6.2029637.433
Alpha-Bisabolol oxide A-ME866699--6.2109283.1913
Ginsenoside Rh8-ME866700--6.2269681.4232
Calanolide ACalanolide AME866701--6.2349415.1743
11-Hydroxyandrosterone-ME866702--6.2429351.2177
ZingeroneZingeroneME866703--6.2509193.0861
Ethyl pentyl ketoneEthyl pentyl ketoneME866704--6.2589173.1175
Prostaglandin D1PGD1ME866705--6.2675353.2333
P-Menthane-3,8-diol-ME866706--6.2915403.3065
EcdysoneEcdysoneME866707--6.2995485.2918
3-Hexenal3-HexenalME866708--6.3236195.1384
2,3-dinor Prostaglandin E12,3-Dinor-PGE1ME866709--6.3236325.2014
Nigakihemiacetal B-ME866710--6.3316435.1989
1,4-Pentanediamine, N4-(5-(hexyloxy)-6-methoxy-4-m...-ME866711--6.3561394.2446
Spinasaponin ASpinasaponin AME866712--6.372793.4396
28-Norbrassinolide-ME866713--6.4367447.3119
(3S,6E)-Nerolidol-ME866714--6.4446267.1964
3-trans-p-Coumaroylrotundic acid-ME866715--6.4446633.38
AVOCADENE ACETATE-ME866716--6.4925327.2539
PE(PGJ2/18:1(9Z))-ME866717--6.5172816.4765
Melilotoside B-ME866718--6.5331797.4704
Ethyl glucuronideEthyl glucuronideME866719--0.7028503.1617
19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid-ME866720--6.5491451.2855
DiethylpropionDiethylpropionME866721--6.5571250.1446
Docosanedioic acidDocosanedioic acidME866722--6.6136415.3066
18-Dehydroursolic acid 3-arabinoside-ME866723--6.6136567.3697
Sugeonol-ME866724--6.6216467.3168
Echinocystic acid-ME866725--6.6614471.3483
Carmofur-ME866726--6.6774573.25
24-Oxo-1alpha,23,25-trihydroxyvitamin D3-ME866727--6.6934467.2807
Algestone-ME866728--6.7254367.189
TetradecanalMyristaldehydeME866729--6.7334257.2119
1,9-Heptadecadiene-4,6-diyne-3,8-diol, (3S,8S,9Z)--ME866730--6.7573519.3495
PentadecanalPentadecanalME866731--6.7657271.2277
Carbenoxolone-ME866732--6.867591.3284
(2'E,4'Z,7'Z,8E)-Colnelenic acid-ME866733--6.875273.1859
(R)-2-Hydroxystearic Acid-ME866734--6.875299.2589
Gamma-Tocotrienolgamma-TocotrienolME866735--6.883455.3167
Dipropyl-5-CT-ME866736--6.8989633.4168
Doxercalciferol-ME866737--6.9069457.3325
18-HEPE18-HEPEME866738--6.9069635.4303
Pomiferin-ME866739--6.9148401.1424
Linoleic acidLinoleic acidME866740--6.9228301.2171
27-Hydroxyisomangiferolic acid-ME866741--6.9228453.3375
TrehaloseTrehaloseME866742--0.6629387.1143
3beta-Hydroxy-5,7-androstadien-17-one-ME866743--7.0915617.3862
Dodecyl Hydrogen Sulfate-ME866744--7.5078265.1476
UridineUridineME866745--0.8392243.062
4-(undecan-5-yl)benzene-1-Sulfonic Acid-ME866746--7.7171311.1685
4-Decan-4-Ylbenzenesulfonic Acid-ME866747--7.6766297.1527
2-Dodecoxyethyl Hydrogen Sulfate-ME866748--7.6686309.174
Bufotalin-ME866749--7.2749443.2474
Rehmannic acid-ME866750--7.1871551.3746
Furohyperforin-ME866751--6.9627551.3796
Leptomycin B-ME866752--6.9308521.3253
1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)...-ME866753--6.9148485.2826
Falcarindiol-ME866754--6.9069519.3485
Arenobufagin-ME866755--6.9069437.192
PA(20:4(5Z,8Z,11Z,13E)+=O(15)/20:2(11Z,14Z))-ME866756--6.8989807.476
NORETHINDRONE ACETATENorethisterone acetateME866757--6.883339.1997
PalmitaldehydePalmitaldehydeME866758--6.875285.2433
Soyasapogenol A-ME866759--6.867455.3532
Medicagenic acid-ME866760--6.8591483.3116
6-beta-hydrocortisol-ME866761--6.8266423.2025
4alpha-carboxy-5alpha-cholesta-8,24-dien-3beta-ol-ME866762--6.8186473.3271
Mahanimbinol-ME866763--6.7817665.4066
Scyphostatin-ME866764--6.7817506.2911
Boldenone-ME866765--6.7493631.4004
Lauroyl peroxide-ME866766--6.7493443.3376
ArginyllysineArg-LysME866767--6.7413649.4113
3-Indolebutyric acid3-Indolebutyric acidME866768--6.7334465.2049
Frangulanine-ME866769--6.7094535.3051
LeupeptinLeupeptinME866770--6.7094407.2763
PA(PGE1/P-16:0)-ME866771--6.7014751.4494
3'-thiacytidine-ME866772--3.2038266.0199
11H-14,15-EETA14,15-Ep-11-HETrEME866773--6.6694317.2119
3a,11b,21-Trihydroxy-20-oxo-5b-pregnan-18-al3alpha,11beta,21-Trihydroxy-20-oxo-5beta-pregnan-18-alME866774--6.6614385.1999
3-Hydroxysintaxanthin-ME866775--6.6535937.6434
JervineJervineME866776--6.6535424.2834
Pyrrhoxanthinol-ME866777--6.6296605.3082
19-Oxotestosterone-ME866778--6.6136663.3904
Perfluorooctanoic acidPerfluorooctanoic acidME866779--6.6136412.9665
1,2-Anhydridoniveusin-ME866780--6.6136357.1357
11(R)-HEDE11R-HEDEME866781--6.6136323.259
(9Z,12R)-12-Hydroxyoctadec-9-enoic acid-ME866782--6.589297.2433
Arabinofuranosylguanine-ME866783--1.9077266.0893
Arbaprostil-ME866784--6.5651387.217
N-OCTANOYL-L-HOMOSERINE LACTONE-ME866785--6.5491499.307
PG(20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)/20:3(5Z,8Z,11Z)...-ME866786--3.8729879.498
Notoginsenoside J-ME866787--3.9748879.4977
TetrahydrocortisoneTetrahydrocortisoneME866788--6.5172363.2155
PGP(18:0/16:1(9Z))-ME866789--6.5005827.4814
Prostaglandin D1 Alcohol-ME866790--6.4765339.2539
Strophanthidin-ME866791--6.4685385.2004
GeosminGeosminME866792--6.4685203.1435
(3S)-3-hydroxycyclocitral-ME866793--6.4605381.2269
5,10-Pentadecadien-1-ol-ME866794--6.4446269.2121
(17alpha,23S)-17,23-Epoxy-29-hydroxy-27-norlanosta...-ME866795--6.404467.2805
Cannabigerolate-ME866796--6.404405.2282
5-Hydroxyindoleacetate5-Hydroxyindoleacetic acidME866797--4.4799172.0396
2-Methoxyestrone2-MethoxyestroneME866798--6.38345.1709
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME866799--6.372431.3377
Majonoside R1-ME866800--4.7039861.4873
12,13-DHOME12,13-DiHOMEME866801--6.3641359.2439
Floionolic acidPhloionolic acidME866802--6.3641331.2489
Dodecylbenzenesulfonic AcidDodecylbenzenesulfonic acidME866803--6.3561325.1842
PulegonePulegoneME866804--6.3561197.1177
Mono(glucosyluronic acid)bilirubin-ME866805--6.3316797.2406
NarirutinNarirutinME866806--6.3316561.156
(S)-10,16-Dihydroxyhexadecanoic acid-ME866807--6.3316287.2226
Hexylresorcinol-ME866808--6.3236433.2595
TestosteroneTestosteroneME866809--6.3236333.2071
NeocnidilideNeocnidilideME866810--6.3236239.1285
Vinaginsenoside R13-ME866811--4.14181025.556
Suberic AcidSuberic acidME866812--5.0229173.0811
(1R,2S,3S,4R)-p-Menthane-2,3-diol-ME866813--6.2589389.291
NandroloneNandroloneME866814--6.2429319.1914
Hippuryl-histidyl-leucine-ME866815--6.2349410.1817
Cis-12-Oxophytodienoic acid-ME866816--6.2349337.2021
(10betaH,11xi)-11-Hydroxy-13-nor-6-eremophilen-8-o...-ME866817--6.2109267.1601
2beta-Hydroxytestosterone-ME866818--6.2029349.2021
9-Oxo-nonanoic acid9-Oxo-nonanoic acidME866819--6.2029171.1018
Ginsenoside F1-ME866820--6.1948683.4387
Dynorphin A 1-8-ME866821--4.03831025.5562
1,4-Cyclohexanedicarboxylic acid-ME866822--5.3628171.0654
Triamcinolone acetonide 21-palmitate-ME866823--5.3548717.4442
18R-hydroxy-5Z,8Z,11Z,14Z,16E-eicosapentaenoic aci...18R-HEPEME866824--6.1869339.1921
Tragopogonsaponin A-ME866825--6.1782693.3869
Thromboxane B2TXB2ME866826--6.1782369.2282
9,10,13-TriHOME9,10,13-TriHOME(11)ME866827--6.1782329.2332
Bolandiol-ME866828--6.1622321.207
Artemorin-ME866829--6.1622247.1336
RishitinRishitinME866830--6.1542503.3381
Vinaginsenoside R12-ME866831--5.5618717.4443
PS(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/18:0)-ME866832--6.1462846.4909
Notoginsenoside A-ME866833--6.1462561.2917
2-Hydroxycineol-ME866834--6.1382215.1284
NigericinNigericinME866835--6.1302769.4756
Cinncassiol D3-ME866836--6.1142367.2128
Ginsenoside Rb1-ME866837--6.1062553.295
Lexacalcitol-ME866838--6.1062505.3538
Coniferyl AldehydeConiferyl aldehydeME866839--6.1062177.0549
Ginsenoside Ra2-ME866840--6.0982604.3109
Majoroside F6-ME866841--4.75991007.5456
3-Hexen-1-ol-ME866842--6.0982245.1756
2-Aminooxybenzoic acid-ME866843--6.0982152.0344
PIP(18:0/18:1(9Z))-ME866844--5.7778989.5352
Ferulic Acidtrans-Ferulic acidME866845--6.0896193.05
Mono-(2-ethyl-5-carboxypentyl) phthalateMono-(2-ethyl-5-carboxypentyl) phthalateME866846--6.0816329.1032
Ginsenoside M7cd-ME866847--5.7938699.4336
PG(i-19:0/PGJ2)-ME866848--6.0656863.5004
Mabioside D-ME866849--5.8018843.4766
SulindacSulindacME866850--6.0656401.0879
Azelaic AcidAzelaic acidME866851--5.8338187.0969
5-Deoxykievitol-ME866852--5.8418337.1081
Cibaric acid-ME866853--6.0576305.1758
Sebacic AcidSebacic acidME866854--6.0431201.1126
1-Methyladenosine1-MethyladenosineME866855--6.03318.0618
L-2,3-Dihydrodipicolinate-ME866856--5.9977168.0294
Notoginsenoside C-ME866857--5.9674569.2901
2-(Trifluoromethoxy)anisole-ME866858--5.9125213.0148
Neocnidolide-ME866859--5.7058239.1285
2-Methoxy-5-nitrophenol-ME866860--5.7058168.0294
Phenoxyacetic Acid-ME866861--5.2588151.0391
AcebutololAcebutololME866862--5.0149371.171
12-Hydroxyjasmonic acid glucoside-ME866863--4.7599369.1554
Cinncassiol A-ME866864--4.7439381.1918
Acetyl-DL-Leucine-ME866865--4.6799172.097
6-Hydroxyhexanoic Acid6-Hydroxycaproic acidME866866--4.6719131.0703
(+/-)-Pelletierine-ME866867--4.6239186.1128
Nonactinic Acid-ME866868--4.5919201.1125
Leptin F-ME866869--6.0656389.1395
N-AcetylleucineN-AcetylleucineME866870--4.4559172.0971
Phthalic AcidPhthalic acidME866871--4.4244165.0184
3,4-Dimethylbenzenesulfonic acid-ME866872--4.3054185.027
3,4-Methylenedioxybenzaldehyde-ME866873--4.2749149.0234
5-(4-Methyl-5-Oxo-2H-Furan-3-Yl)Pentanoic Acid-ME866874--3.8169197.0813
3-Hydroxybenzoic Acid3-Hydroxybenzoic acidME866875--3.7849137.0234
PSOROMIC ACIDPsoromic acidME866876--6.0896357.0616
P-Toluenesulfonic Acid-ME866877--3.3158171.0113
Matairesinol-ME866878--5.9393357.1344
Methyl 2-Hydroxyisobutyrate-ME866879--3.1878117.0546
SM(d18:2(4E,14Z)/PGJ2)-ME866880--6.1142815.4815
DanieloneDanieloneME866881--3.0368211.0605
Leucyl-ValineLeu-ValME866882--2.8743229.1553
ThreonylleucineThr-LeuME866883--2.8583231.1345
2-Hydroxypentanoic Acid2-Hydroxyvaleric acidME866884--2.8342117.0546
Xanthoplanine-ME866885--6.1142391.1551
Acetylvalerenolic acid-ME866886--6.1302291.1601
N-Acetyl-D-tryptophanN-Acetyl-D-tryptophanME866887--2.5156267.0732
2-Hydroxy-3-Methylbutyric Acid2-Hydroxy-3-methylbutyric acidME866888--2.4796117.0545
Licoricesaponin B2-ME866889--6.1462807.419
OxypurinolOxypurinolME866890--1.4397151.0252
2,6-diamino-4-hydroxy-5-formamidopyrimidine-ME866891--0.8313150.0411
FAPy-adenineFAPy-adenineME866892--0.8313134.0461
Gibberellin A14-ME866893--6.2349347.1864
MaltotetraoseMaltotetraoseME866894--0.7833711.219
DIDPdIDPME866895--0.7188457.0161
Glyceryl 5-hydroxydecanoate-ME866896--6.2755243.1599
Ezetimibe-glucuronide-ME866897--0.7028566.1575
5'-Methylthioadenosine5'-MethylthioadenosineME866898--0.6949890.2649
Peperinic acid-ME866899--6.0736363.1817
Vinaginsenoside R17-ME866900--6.3316961.5399
20-Cooh ltb4-ME866901--6.372379.2108
Momordin B-ME866902--6.42677.3925
Ginsenoside C-ME866903--6.1462829.4974
13(S)-HODE13S-HODEME866904--6.5085295.2276
15-HETE15-HETEME866905--6.5411319.2277
VIQUALINE-ME866906--6.5411665.4057
2,6-Dichloro-4-nitrophenol-ME866907--0.4494243.899
MJDBISSN00000009-ME866908--2.5156169.1022
MJDBISSN00000003-ME866909--6.3641411.3054
MJDBISSN00000001-ME866910--3.2038198.032
Ginsenoside Rd-ME866911--6.2429991.5507
Notoginsenoside T2-ME866912--6.6296665.4295
Ramifenazone-ME866913--6.7014489.3028
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-...-ME866914--6.6296457.3326
Lycopersiconolide-ME866915--6.7413723.4851
9(S)-HpOTrE9S-HpOTrEME866916--6.2835309.2071
Ganoderiol I-ME866917--6.867523.3406
Corchorifatty acid D-ME866918--6.3075307.1914
9-Oxo-11-(3-pentyloxiran-2-YL)undec-10-enoic acid-ME866919--6.396291.1964
Dihydrocorticosterone-ME866920--6.9148369.2046
Ginsenoside F2-ME866921--6.4605829.497
Isopetasoside-ME866922--6.1948395.2066
Mutant IDH1 inhibitor-ME866923--6.5651465.2646
Chikusetsusaponin Ia-ME866924--6.5251799.4864
Ginsenoside Rh2(S-FORM)-ME866925--6.6614667.4442
4,4-Dimethyl-2-[3-carboxylatopropyl]-2-tridecyloxa...-ME866926--6.8056384.3119
NevirapineNevirapineME866927--6.0816287.0926
OvalicinOvalicinME866928--6.0576341.1605
4-Methoxy-1-naphthol-ME866929--6.0355407.1501
Vinaginsenoside R4-ME866930--6.0098961.5397
1-Hydroxy-2,5-dioxopyrrolidine-3-sulfonic acid-ME866931--0.4734175.9678
ACRL Toxin II-ME866932--6.1382307.1552
H-Tyr-gly-gly-phe-leu-arg-arg-ile-OH-ME866933--5.92311025.555
Ginsenoside B2-ME866934--5.9125991.5511
2-phospho-D-glycerate2-Phosphoglyceric acidME866935--0.5672163.9505
3-Methyl-2-Oxovaleric Acid3-Methyl-2-oxovaleric acidME866936--3.8569129.0546
4-Hydroxy-3-polyprenylbenzoate-ME866937--6.2269273.1496
4-Nitrophenol4-NitrophenolME866938--5.7218138.0186
4a-Methylzymosterol-4-carboxylic acid4alpha-Carboxy-4beta-methyl-zymosterolME866939--6.6296423.327
4alpha-carboxy-4beta-methyl-5alpha-cholesta-8,24-d...-ME866940--6.404487.3432
9,10-Dihydroxystearic acid9,10-Dihydroxystearic acidME866941--6.4765315.2538
9,10-Epoxyoctadecanoic acid-ME866942--6.4526313.2383
BrassinolideBrassinolideME866943--6.0982501.3226
Dodecanedioic AcidDodecanedioic acidME866944--6.2029229.1441
Ginsenoside Rf-ME866945--5.9352845.4922
Hexadecanedioic acidHexadecanedioic acidME866946--6.3482285.207
Jasmonic acid methyl esterMethyl jasmonateME866947--6.0496269.1392
L-GlutamateGlutamic acidME866948--0.6077146.0449
Malic AcidMalic acidME866949--0.8152133.0132
OxotremorineOxotremorineME866950--7.0527617.4211
Prostaglandin J2PGJ2ME866951--6.6375315.1963


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