{"database":"MetabolomicsWorkbench","file_versions":[{"headers":{"Content-Type":["application/json"]},"body":{"files":{"Other":["http://www.metabolomicsworkbench.org/rest/study/study_id/ST001875/mwtab"]},"type":"primary"},"statusCodeValue":200,"statusCode":"OK"}],"scores":null,"additional":{"omics_type":["Metabolomics"],"technology_type":["Mass Spectrometry","ESI"],"species":["Mus Musculus"],"full_dataset_link":["http://www.metabolomicsworkbench.org/data/DRCCMetadata.php?Mode=Study&StudyID=ST001875"],"study_factor":["Source:Mouse liver | MS2 CE:30V","Source:Mouse feces | MS2 CE:30V","Source:Mouse liver | MS2 CE:45V","Source:Mouse feces | MS2 CE:45V","Source:Mouse liver | MS2 CE:15V","Source:Mouse feces | MS2 CE:15V"],"tissue":["Liver","Feces"],"submitter_affiliation":["Dalian Institute Of Chemical Physics"],"sample_protocol":["Reversed phase NEGATIVE ION MODE."],"repository":["MetabolomicsWorkbench"],"metabolite_name":["Cerebroside","DEOXYCARNITINE","Coniferaldehyde","Acenapthylene","Dimethyl??sulfoxide","Corticosterone","1-Lauroyl-2-hydroxy-sn-glycero-3-phosphocholine","Saikosaponin C","DEOXYCHOLATE","(4R)-4-((3R,5R,6S,7R,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Phenylacetylglutamine","N-Acetyl-tryptophan; LC-tDDA; CE40","(R)-4-((3S,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","o-Hydroxyhippuric acid","Folic acid","N-lauroylethanolamine","Urolithin A","PC 17:0-20:3-d5_ISTD","dioctylamine","Albuterol","L-Histidine","DEP_178.1226_15.3","Reserpine","Diazepam","2-Benzoxazolinone","alpha-Glutamyl-Tyrosine","GLYCINE","4-Hexylresorcinol","Saikosaponin a","Vasicinone","Glycochenodeoxycholic acid; LC-tDDA; CE40","(2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8aR,9R,12aS,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid","Biotin","PC(16:0/0:0)","1,5-Naphthalenediamine","L-Proline","PIPECOLIC ACID","1-Methylxanthine","Troxipide","methyl (R)-4-((3R,5S,7R,8S,9S,10S,13R,14R,17R)-3,7,14-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate","5-OHMe-Ur","CARVONE","Imidocarb","Tripalmitin","5-Hydroxyindoleacetic acid","4-Methylcoumarin","TRIMETHYLAMINE N-OXIDE","SN-GLYCERO-3-PHOSPHOCHOLINE","2-Phenylglycine [M+H-NH2]+; AIF; CE10; MS2Dec","MALTOTRIOSE","9-HOTrE","Phenylalanylphenylalanine; LC-tDDA; CE40","Pilocarpine","Roquefortine A","NCGC00385291-01_C19H30O8_3-Buten-2-one, 4-[4-(beta-D-glucopyranosyloxy)-2-hydroxy-2,6,6-trimethylcyclohexylidene]-","3-Ketocholanic Acid","Lauramidopropyl betaine","2-((4R)-4-((3R,5R,6S,7R,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid","Alliin; LC-tDDA; CE20","THE","(4R)-4-((3S,5R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","18:1(2S-OH) Ceramide","INDOLEACETALDEHYDE","FERULIC ACID","6-Acetyl-1,1,2,4,4,7-hexamethyltetralin","Sclareol","Flavin??adenine??dinucleotide","GLYCEROL-MYRISTATE","2-Hydroxyquinoline","NCGC00380283-01!4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoic acid","Estriol","PHENYLALANINE","Phytosphingosine (not validated, isomer of 1696)","Galaxolidone","4-Quinolinecarboxylic acid","Solasodin","Betaine; CE30","N-Acetylglutamic acid","Methyltestosterone","6-Methylflavonol","Chrysoeriol","N2_N2-Dimethylguanosine","Cyclo(Leu-Pro)","(3R,5R,7R,8S,9S,10S,12S,13R,14S,17R)-17-((R)-7-hydroxy-6-(hydroxymethyl)heptan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol","y-Linolenic acid","2-Naphthalenol","ISOVALERYLGLYCINE","Oleyl sarcosine","Glycitein","4,4'-Sulfonyldiphenol","1-palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine","2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid","Isophorone","4-Methyl-5-thiazoleethanol","NCGC00169595-03_C20H32O3_[(2R,5R,8a'S)-2',5,5',5',8a'-Pentamethyl-4,4a',5,5',6',7',8',8a'-octahydro-3H,4'H-spiro[furan-2,1'-naphthalen]-5-yl]acetic acid","Oleamide","NCGC00336197-02!(1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one [IIN-based on: CCMSLIB00000847435]","10-HYDROXYDECANOATE","N-Acetyl-5-hydroxytryptamine","Stearoyl-carnitine; LC-tDDA; CE20","trans-Ferulic acid; [M+H-H2O]+","Decanoyl-L-carnitine D3","4-Pyridoxic acid","INDOLE-3-ETHANOL","NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585]","NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE","Guanosine","Arachidonoyl-carnitine; LC-tDDA; CE30","Xanthurenic acid","Dehydrosalsolidine","4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol","LAUROYLCARNITINE","STIGMASTA-4,22-DIEN-3-ONE","Buspirone","Valerophenone","Octaethylene glycol","Phthalic acid","Indole-3-acetyl-L-alanine","Biliverdin","NCGC00180676-03_C20H36O3_1-Naphthalenepentanoic acid, decahydro-2-hydroxy-beta,2,5,5,8a-pentamethyl-, (betaS,1R,2R,8aS)-","DL-Coniine","Morphine_3_Glucuronide","lithocholic acid","Isorhynchophylline","CYTOSINE","DG(20:4(5Z,8Z,11Z,14Z)/0:0/20:4(5Z,8Z,11Z,14Z)) (d5)","NCGC00385316-01_C20H32O3_1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-beta,2,5,5,8a-pentamethyl-3-oxo-, (8aS)-","Pyridine","2-Methylindole","4-Hydroxyquinoline","Pterosin A","Raloxifene","MMV028694","5-HYDROXYINDOLE","(2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid","Ethylparaben","N-[1,3-dihydroxyoctadec-4-en-2-yl]tetracos-15-enamide","Pterosin B","NCGC00142553-05!5,7-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000848562]","IS_TRYPTOPHAN-2,4,5,6,7-D5","4-Acetamidobutyric acid","taurodeoxycholic acid","Cysteine","O-Phosphocholine","alpha-Linolenoyl Ethanolamide","(R)-4-((3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","PYRIDOXAL","Equol","Proline","Indole-3-carbinol","GLYCOCHENODEOXYCHOLATE","(4R)-4-((3R,5S,7S,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","hyocholic acid","IS_PHENYLALANINE-2,3,4,5,6-D5","4-Methylpyrimidine","4-Aminohippuric acid; AIF; CE0; MS2Dec","Resibufogenin","INDOLEACETIC ACID","(R)-4-((5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-dioxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Loliolide","5-OXO-D-PROLINE","13-OxoODE","N1-Methylguanosine; LC-tDDA; CE40","URSOCHOLIC ACID","L-Thyroxine","Adenosine","LACTULOSE","PC(16:0/18:1(9Z))","CHOLINE","4-AMINOBENZOIC ACID","12(13)-EpOME-[d4]","Uric acid","1H-indole-3-carboxylic acid","hypericin","Linoleic acid","DEET","(4R)-4-((3R,5S,7S,8R,9S,10S,12R,13R,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","NCGC00384702-01!(2Z,6E,10E)-12-hydroxy-6,10-dimethyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid [IIN-based on: CCMSLIB00000846288]","Acetylcarnitine","Dibucaine","Adipoyl-carnitine; LC-tDDA; CE40","Dehydrocorydaline","Tri(butoxyethyl)phosphate","Benzoic acid","L-Phenylalanine","Daidzin","4-HYDROXYPHENYL ACETIC ACID","5-Methylcytosine","3,4-Dihydroxy-L-phenylalanine","Trachelanthine","Trazodone","Docosahexaenoic acid","gamma-Glutamyltyrosine","P-ANISALDEHYDE","DErySphingosine","Ecgonine","INDOLE","Spermidine","h_52_drostanolone-m","Triacylglycerol 16:0-18:1-18:1","5-AMINOLEVULINIC ACID","Disulfiram","LPC 18:2","LPC 18:3","3?-Hydroxy-7 Ketolithocholic Acid","2-Naphthylamine","(4R)-4-((3R,5R,6S,7S,9S,10R,13R,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","FA 18:3+1O","gamma-Glutamylleucine","Dropropizine","Bis(2-ethylhexyl)phosphate","gamma-Undecalactone","Threonine","C16 Lactosyl Ceramide (d18:1/16:0)","LPC 18:1","2-((R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid","NALOXONE","PHENYLETHANOLAMINE","OCTANOYLCARNITINE","Glutaryl-carnitine; AIF; CE10; MS2Dec","D-(+)-Glucosamine","PIPECOLINIC ACID","2',2'-Difluoro-2'-deoxyuridine","Lycopsamine","N-Acetyl-tyrosine; LC-tDDA; CE20","MAG","Lysine","Acetaminophen","(S)-(-)-Perillic acid","SSR180711","Bis[2-(2-butoxyethoxy)ethyl] hexandioate","Adipoyl-carnitine; LC-tDDA; CE20","3-Formylindole","NICOTINURIC ACID","Glutamic acid","Pterosin G","NCGC00381364-01!3-propan-2-yl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione","Suberic acid","N-Oleyl-Leucine","N6,N6-dimethyllysine","Zearalenone","THYMINE","Hexanoyl-carnitine; AIF; CE30; CorrDec","Paeonol","MMV688469","URACIL","Meperidine","Guanine","Pyrimidine","Tri-N-butyl phosphate","(3S,8S,9S,10R,13R,14S,17R)-17-((2R)-7-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol","Piperine","O6-MeG","4-GUANIDINOBUTANOATE","Deoxykhivorin","17-Methyltestosterone","S-Adenosylhomocysteine (SAH)","Quetiapine","N-Acetylphenylalanine","Adipoyl-carnitine; LC-tDDA; CE10","2-acetoxy-4-pentadecylbenzoic acid","N-METHYLNICOTINAMIDE","Glyceryl trioleate","UROCANATE","Xanthosine","S-Adenosyl-homocysteine (SAH); LC-tDDA; CE30","Dothiepin","Aspartate","NCGC00384643-01_C20H32O2_(2E)-3-Methyl-5-[(1S,8aS)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]-2-pentenoic acid","Glycylleucine","1-heptadecanoyl-2-hydroxy-sn-glycero-3-phosphocholine","N6-Me-Adenosine","PARAXANTHINE","Valine","Isobutyryl-carnitine; LC-tDDA; CE10","Glycolithocholic acid","D-beta-Homophenylalanine","Triphenyl phosphate (TPP)","N,N-Dimethylformamide","(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one","Di-n-butyl phthalate","h_315_oxymetholone_m2","(R)-4-((3R,5R,6R,7R,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","delta4-Dafachronic acid","2-Hydroxychalcone","Thiabendazole","Hexaethylene glycol","Dihydrobiopterin","INDOLELACTIC ACID","Dioctyl Phthalate","Phenylacetylglycine; LC-tDDA; CE10","Adenosine_Diphosphate","Methylthioadenosine","8-[3-oxo-2-[(E)-pent-2-enyl]cyclopenten-1-yl]octanoic acid","Nadolol","deoxycholic acid","Bilirubin","Phosphorylcholine; LC-tDDA; CE20","CREATINE","Glutathione oxidized","1,4-Chrysenequinone","TAG(50:1)","Ibuprofen","Cholest-4,6-Dien-3-One","Ortophosphate","Phenacetin","Glutathione (reduced)","2,8-Quinolinediol; AIF; CE10; CorrDec","METHYL INDOLE-3-ACETATE","(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid","5-Aminovaleric acid betaine","N,N-Dimethyldodecylamine N-oxide","Palmitoyl-carnitine; LC-tDDA; CE20","Nudifloramide; LC-tDDA; CE20","Lauric isopropanolamide","CHOLATE","Leucine_Enkephalin","Glutamate","Atenolol","Heneicosanoic acid","7-Diethylamino-4-methylcoumarin","Tryptophan betaine","Phosphorylcholine; LC-tDDA; CE10","Acetaminophen glucuronide","2-(3-Hydroxycyclohexyl)-5-(2-methyl-2-octanyl)phenol","Mono-iso-butyl phthalate","Linoleyl-carnitine; LC-tDDA; CE20","GAMMA-CAPROLACTONE","Ceratodictyol","Genistein","Phosphorylcholine; LC-tDDA; CE40","ASP-PHE","ortho-Chlorophenylpiperazine","(R)-4-((1R,3S,5R,8S,9S,10S,13R,14S,17R)-1,3-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Thymol","L-beta-Homoisoleucine","Norethindrone","N6-Methyl-lysine; AIF; CE0; CorrDec","ELAIDIC ACID","PYROGLUTAMIC ACID","Lysine; LC-tDDA; CE40","1-pentadecanoyl-2-hydroxy-sn-glycero-3-phosphocholine","2,4,6-Trimethylpyridine","Quinoline; LC-tDDA; CE20","Glycocholic Acid","3-[4-methyl-1-(2-methylpropanoyl)-3-oxocyclohexyl]butanoic acid","(E,6S)-7-hydroxy-2-methyl-6-[(10S,13S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-2-enoic acid","Luteolin-7-O-glucoside","Triphenylphosphine oxide","Acetyl tributyl citrate","Stercobilin","gamma-Dodecalactone","Tripropilamine","NCGC00384702-01!(2Z,6E,10E)-12-hydroxy-6,10-dimethyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid [IIN-based: Match]","Glycohyocholic acid","Hydroxyzine","Monoolein","Dicyclohexylurea","AM580","Maltol","Sinomenine","4-Hydroxy-6-methyl-2-pyrone","17beta-Trenbolone","C.I. Basic Red 9","2-Hydroxybenzonitrile","Quinoline; LC-tDDA; CE30","OCP_295.0845_17.0","N-ACETYLGALACTOSAMINE","Velvione","Seneciphylline","P-OCTOPAMINE","NCGC00384740-01_C21H34O9_2(1H)-Azulenone, 6-(beta-D-glucopyranosyloxy)-4,5,6,7,8,8a-hexahydro-5-hydroxy-5-(1-hydroxy-1-methylethyl)-3,8-dimethyl-","BETAINE","N-Acetyl-cysteine; LC-tDDA; CE10","2-Methylpyrrolidine","Naltrexone","Trospium","DodeDecanoyl-L-carnitine D3","1-METHYLNICOTINAMIDE","4-(2,5-Diethoxy-4-nitrophenyl)morpholine","2-Aminocaprylic acid; LC-tDDA; CE20","HEXANOYLGLYCINE","Kynurenic acid","beta-Alanine","[2,3-di(heptadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate","4-(Dimethylamino)phenylthiocyanate","Methyl trans-styryl ketone","FA 18:2+O","Trigonelline","INDOLEPROPIONIC ACID","N-Acetylcarnosine","2,8-Quinolinediol","N,N-Dimethylguanosine; LC-tDDA; CE40","N-Acetyl-Asp-Glu","2-methoxy-4-pentadecylbenzoic acid","Flufenacet ESA","Methionine","4-Hydroxyhippuric acid","Lauryldimethylamine Oxide","CAFFEINE","5-Hydroxyindole-3-acetic acid","Octenoyl-carnitine; LC-tDDA; CE10","Catechol","4-Hexyloxyaniline","Cetirizine","MMV688990","NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based on: CCMSLIB00000847074]","Methylimidazoleacetic acid; LC-tDDA; CE30","Tri(butoxyethyl) phosphate","THIAMINE","7-Methylguanine; LC-tDDA; CE20","7-Hydroxymitragynine","(4R)-4-((1R,3S,5S,7R,9S,10S,13R,14S,17R)-1,3,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","N6-Isopentenyladenosine","Nonaethylene glycol","RIBOFLAVIN","Lidocaine-N-Oxide","4-Methoxyaniline","Gabapentin","HYDROXYPHENYLLACTIC ACID","Stearoyl Ethanolamide","6-beta-Hydroxycortisol","Citrinin","LINOLENIC ACID","Lauryldiethanolamine","(R)-4-((3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pent-2-enoic acid","Quinaldic acid","Azacyclotridecan-2-one","Arachidonoyl Ethanolamide","L-Tryptophan","(Z)-3-(4-hydroxyphenyl)-N-[4-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide","Thymidine; LC-tDDA; CE30","delta-Aminolevulinic acid","Tentoxin","PYRIDOXINE","Threonylleucine (isomer of 809, 926)","Glycocyamine","N-Acetyl-cysteine; LC-tDDA; CE20","N-(CINNAMOYL)GLYCINE","Nordihydroguaiaretic acid","Propionyl-carnitine","N-Oleoylethanolamine","Diethyl-phthalate","ALPHA-D-GLUCOSE 1-PHOSPHATE","Aniline; AIF; CE30; CorrDec","Cholesterol","L-beta-Homoleucine","Pantothenate","2-QUINOLINECARBOXYLIC ACID","Walleminone","Dibutylphthalate","Taurine; LC-tDDA; CE10","(R)-4-((3R,5R,6R,7R,8R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Etilefrine","Hexylamine","[6]-Gingerol","Xanthoxylin","(2S,3S,4S,5R,6R)-6-(((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-4-carboxybutan-2-yl)-7,12-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid","4-AMINOBUTANOIC ACID","1,7-Dimethyluric acid","Taurodeoxycholate","8-Hydroxyquinoline","Divarinol","Tryptamine","Taurocholate","taurocholic acid","GLYCOCHENODEOXYCHOLIC ACID","Valeryl-carnitine; AIF; CE10; CorrDec","5?-CHOLANIC ACID-3?_ 6?_7?-TRIOL","NCGC00385854-01_C14H19N3O4_N~5~-Carbamoyl-N~2~-(phenylacetyl)ornithine","Morphine","N-Acetylcytidine","??-Gentiobiose","Anabasamine","Heptadecanoyl Ethanolamide","Diaveridine","Tricin","Taurine; LC-tDDA; CE40","THEOBROMINE","N6-Succinyladenosine; AIF; CE0; MS2Dec","(R)-4-((3S,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Nordiazepam","Fenpropimorph","Flavone base + 3O, 2MeO, O-guaiacylglycerol","2-Acetylpyrazine","2-Oxindole; LC-tDDA; CE10","Laurocapram","Leucyl-leucine; LC-tDDA; CE40","Tyrosine","Quinolone","4-hydroxybenzaldehyde","(4R)-4-((5S,7R,9S,10S,13R,14S,17R)-7-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","LPC 16:0","2-Aminoethanethiol","N2,N2-Dimethylguanosine","N-ACETYL-ASPARTIC ACID","C17_Sphingosine","2-ETHYL-3-HYDROXY-4H-PYRAN-4-ONE","Spermine","Sphinganine (C17 base)","OPHTHALMIC ACID","FERULATE","Hypoxanthine","Leucyl-leucine; LC-tDDA; CE30","6-Quinolinol","Nicotine","L-Arginine","NCGC00385110-01_C20H38O2_(2R)-1-(5-Hydroxy-3-methylpentyl)-2,5,5,8a-tetramethyldecahydro-2-naphthalenol","CARNITINE","Hippuric acid","6-methoxyquinoline","dimethyl(tetradecyl)amine","Enterolactone","LysoPC(0:0/18:0)","ANTHRANILATE","(4R)-4-((3R,5R,6S,7R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylic acid","NCGC00380830-01!methyl 2-[(2-hydroxy-3-methylbutanoyl)amino]-3-methylbutanoate [IIN-based on: CCMSLIB00000845070]","N8-Acetylspermidine","(4S,4aR,8aS)-4-[(3R)-3-hydroxy-3-methylpent-4-enyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4H-naphthalen-1-one","Tributylamine","Liquiritigenin","(4R)-4-((3R,5R,6S,7R,9S,10R,12S,13R,17R)-3,6,7,12-tetrahydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Flumequine","glycoursodeoxycholic acid","Myristoyl-carnitine; LC-tDDA; CE30","DECANOYLCARNITINE","TRIMETHYLAMINE","PSICOSE","Isoleucine","L-Glutamic acid","TREHALOSE","7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one","SPHINGANINE","Adenine","URSODEOXYCHOLATE","N-Acetylmuramic Acid","Cortisone","7,8-dimethylalloxazine (lumichrome)","3-HYDROXY-2-METHYL-4-PYRONE","Ethylrhoeagenine","(R)-4-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Benzyl-butyl-phthalate","NCGC00385702-01!(2S,3R,5R,10R,13R,14S,17R)-17-[(2S,3R)-3,6-dihydroxy-6-methylheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one [IIN-based on: CCMSLIB00000845083]","N7-Et-G","D-ribo-Phytosphingosine","N6-Threonylcarbamoyladenosine","2-Deoxyadenosine; LC-tDDA; CE10","N-Oleoyl-Phenylalanine","Inosine","Myristoyl-carnitine; LC-tDDA; CE20","3?-Hydroxy-12 Ketolithocholic Acid","7-Oxocholesterol","2-Oxindole; LC-tDDA; CE20","Serylleucine","Phenytoin","Glutamine","Ergothioneine; LC-tDDA; CE30","h_60_epimethendiol","NCGC00380990-01!(2E,4E)-12-hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid","(4R)-3-methylidene-4-[(E)-3-methyl-4-(4-methyl-5-oxooxolan-2-yl)but-2-enyl]oxolan-2-one","NICOTINIC ACID","dG-C8-4-CA","Deethylatrazine","Cholic acid","Glutamic acid gamma methyl ester","(Z)-5,8,11-trihydroxyoctadec-9-enoic acid","Benzoylecgonine","2-((4R)-4-((3R,5S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid","Histidine","(+)-Costunolide","5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one","Dehydrophytosphingosine (not validated, isomer of 1679)","Oleoyl-carnitine; LC-tDDA; CE20","3-Methylhistidine","Stearamide","Tyramine","4-Hydroxybenzoylcholine","Pentadecanoyl Ethanolamide","4-Cholesten-3-one","Cucurbitacin I","2-Phenylglycine [M+H-NH2]+; AIF; CE0; MS2Dec","2-Pyrrolidinone; AIF; CE10; CorrDec","HIPPURATE","Decaethylene glycol","2,2'-(Tetradecylimino)diethanol","Ceramide (d18:1/18:0)","Naphthalene","1,6-ANHYDRO-B-GLUCOSE","Oleanane -4H, + 2O","Melezitose","4-ACETAMIDOPHENOL","Nicotinamide","Cysteinylglycine","5-VALEROLACTONE","9-HODE","Formononetin","oroxindin","2-Oxindole; LC-tDDA; CE40","Atractylenolide III","N-C18:0 Phytoceramide","alpha-Hederin","Hexanoyl-L-Carnitine","Trilostane","3-Indoleacrylic acid [M+H-H2O]+; AIF: CE0; MS2Dec","SARCOSINE","N-Acetyl-leucine; LC-tDDA; CE20","1-(4-Methoxyphenyl)-1-pentene-3-one","Dodemorph","alpha-TOCHOPHERYL ACETATE","Picolinic acid","Butyryl-carnitine; AIF; CE10; CorrDec","(6R)-2-(hydroxymethyl)-6-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptyl hydrogen sulfate","Diisobutyl phthalate","1-Dodecyl-2-pyrrolidinone","Kynurenine","taurohyodeoxycholic acid","5-hydroxyculmorin","2-HYDROXYPYRIDINE","Pyridoxamine","9(10)-EpOME-[d4]","Salicylic acid","Dodecanedioic acid","Tryptophan","m-Cumenyl methylcarbamate","Pyroglutamate","Magnolol","Xanthine","(R)-4-((3R,5R,6R,8R,9S,10R,12S,13R,14S,17R)-3,6,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","D-sphingosine","N6-Succinyladenosine; AIF; CE30; MS2Dec","2-PHENYLACETAMIDE","4,6-Di-tert-butyl-m-cresol","Ketamine","L-Glutamine","Mefenamic acid","Glutaryl-carnitine; AIF; CE30; CorrDec","PharmaGSID_48507","COUMARIN","CREATININE","LPE 18:1","LPE 18:2","LPE 18:3","Adenosine 5'-monophosphate","Atrazine-desethyl","NCGC00015088-09_C12H14N2O_N-[2-(1H-Indol-3-yl)ethyl]acetamide","methyl (R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,15S,17R)-3,7,15-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate","2,6-di-tert-Butylphenol","CINNAMIC ACID","(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-6-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Indoline","tauroursodeoxycholic acid","DG(20:5/0:0/20:5) (d5)","Aniline","Naproxen","Tramadol","SPHINGOMYELIN","Adenosine monophosphate (AMP)","Myristamidopropyl betaine","dibutyladipate","NCGC00178486-02!5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one","(2S,3S,4S,5R,6R)-6-(((3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-4-carboxybutan-2-yl)-12-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid","Cotinine","(R)-4-((8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","5,6-Benzoflavone","isochromophilone VI","Atenolol acid","Crystal violet","N-acetyl putrescine","NCGC00384578-01!5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid [IIN-based on: CCMSLIB00000847365]","Acacetin","ANDROSTERONE","Erucamide","S-(5'-Adenosyl)-L-methionine","Exemestane","NCGC00380823-01!2-(14-methylpentadecanoylamino)-3-phenylpropanoic acid [IIN-based on: CCMSLIB00000845077]","?-Tauromuricholic acid","Bufalin","1-OLEOYL-RAC-GLYCEROL","5-S-Methylthioadenosine; LC-tDDA; CE30","Methyltyrosinate","h_128_methyl_1_testosterone","Dimethyl sulfoxide","4-OHE2-1-N7Gua","Diosgenin","3'-Dephosphocoenzyme A","Traversianal","2-Piperidone","3-Aminophenol; LC-tDDA; CE10","Coumaric acid (isomer of 189, 194)","Epigallocatechin","5-Cholesten-3-beta-7-alpha-diol","Hetisine","NCGC00169827-03!(2E,4E)-12-hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid [IIN-based on: CCMSLIB00000847643]","2,6-Xylidine","Leucine","5-methoxyindole-3-carbaldehyde","Citalopram","Heliotrine N-oxide","Linoleoyl Ethanolamide","Azelaic acid","BENZALDEHYDE","3-METHYL-2-OXOBUTANOIC ACID","Intermedine N-oxide","Linoleyl-carnitine; AIF; CE30; CorrDec","2-Aminobenzoic acid","Gentisyl alcohol","Pyrrolidine","BUTANAL","4-Androstene-3,17-dione","Baicalin","Ethoxyquin","Leucyl-Alanine; LC-tDDA; CE40","Diethyltoluamide","Feruloylcholine","Thionin","Ecgonine-methyl-ester (EME)","(R)-4-((3S,5R,6S,7S,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid","Lauryl diethanolamide","5?-CHOLANIC ACID-3?-OL-6_7-DIONE","Caffeoylcholine","Ceramide (d18:1/16:0)","N-Isovalerylglycine","NCGC00380823-01!2-(14-methylpentadecanoylamino)-3-phenylpropanoic acid [IIN-based: Match]","3-METHYLHISTAMINE","Glycodeoxycholic acid","2-((4R)-4-((3R,5S,7R,9S,10S,13R,14R,17R)-3,7,14-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid","Norvaline","N-(2-Phenylethyl)acetamide","Estrone","4-Nonylphenol","Glycochenodeoxycholic acid; LC-tDDA; CE20","Daidzein","3-HYDROXYBENZOIC ACID","1-Stearoyl-sn-glycero-3-phosphocholine","2-Aminoacetophenone"],"data_protocol":[""],"name_synonyms":["Metabonomic, chemical analysis., assay, Metabonomics, Metabolomic, determination"],"sample_synonyms":["backward, reversed."],"additional_accession":[]},"is_claimable":false,"name":"Metabolomics analysis of multiple samples on AB 5600-Part 2","description":null,"dates":{"publication":""},"accession":"ST001875","cross_references":{"TAXONOMY":["10090"]}}