Raw data files in .wiff format were converted to mzXML using ProteoWizard MSConvert. Peak detection, alignment, and feature extraction were performed using the XCMS R package version 3.18.0. Peak picking used the centWave method with mass tolerance of 10 ppm, peak width of 10 to 60 seconds, and prefilter of 10 and 100. Peak grouping parameters were set as bw equal to 5, mzwid equal to 0.025, and minfrac equal to 0.5. Isotope and adduct annotation were performed using CAMERA. Features with more than 50 percent non-zero measurements in at least one group were retained. Metabolites were identified by matching accurate m/z values and MS/MS fragment spectra against the KEGG database. Differential metabolites were selected based on VIP values greater than 1.0 and p-values less than 0.05 from OPLS-DA analysis. Pathway enrichment analysis was performed using KEGG pathway mapping.
"],"repository":["MetaboLights"],"study_status":["Public"],"ptm_modification":[""],"instrument_platform":["Liquid Chromatography MS - positive - hilic","Liquid Chromatography MS - negative - hilic"],"chromatography_protocol":["UHPLC system: Agilent 1290 Infinity LC (Agilent Technologies). Column: ACQUITY UPLC BEH Amide (2.1 mm × 100 mm, 1.7 μm, Waters). Column temperature: 25 °C. Injection volume: 2 μL. Mobile phase A: water containing 25 mM ammonium acetate and 25 mM ammonium hydroxide; Mobile phase B: acetonitrile. Gradient: 0–1 min 85% B; 1–12 min linear decrease to 65% B; 12–12.1 min decrease to 40% B, hold 4 min; 16.1–16.2 min return to 85% B, followed by 5 min re-equilibration. Flow rate: 0.3 mL/min.
"],"publication":["Metabolomics-Based Analysis of Adaptive Mechanism of <i>Eleutheronema tetradactylum</i> to Low-Temperature Stress. 10.3390/ani15081174. PMID:40282008"],"submitter_affiliation":["Guangdong Ocean University"],"submitter_name":["ShuiPing He"],"organism_part":["liver"],"technology_type":["mass spectrometry assay"],"disease":[""],"extraction_protocol":["Approximately 80 mg of frozen liver tissue from each sample (n=3 per group) was homogenized with 200 µL of water and ceramic beads using a homogenizer. Then 800 µL of pre-cooled methanol/acetonitrile (1:1, v/v) was added for metabolite extraction. The mixture was vortexed and centrifuged at 14,000 × g for 15 minutes at 4 degrees Celsius. The supernatant was transferred to a fresh tube and dried under vacuum using a centrifugal concentrator. The dried residue was reconstituted in 100 µL of acetonitrile/water (1:1, v/v) prior to LC-MS analysis. Pooled quality control samples were prepared by mixing equal volumes of all individual samples and were injected periodically throughout the analytical run to monitor system stability and reproducibility. No internal standard was added.
"],"organism":["Elentheronema tetradactylum"],"full_dataset_link":["https://www.ebi.ac.uk/metabolights/MTBLS15459"],"author":["ZhongLiang Wang. Guangdong Ocean University. wangzl@gdou.edu.cn."],"data_transformation_protocol":["Raw LC-MS data files (.wiff) were converted to mzXML format using ProteoWizard MSConvert. Peak detection, retention time alignment, and feature grouping were performed using XCMS software (v3.18.0) in R. Peak picking was conducted using the centWave method with the following parameters: mass tolerance = 10 ppm, peak width = c(10, 60), prefilter = c(10, 100). Peak grouping parameters were set as bw = 5, mzwid = 0.025, and minfrac = 0.5. Isotope and adduct annotation were performed using CAMERA. Features with more than 50% non-zero measurements in at least one group were retained. The resulting peak intensity table was used for subsequent multivariate statistical analysis.
"],"study_factor":["Exposure-time","Low temperature"],"submitter_email":["hexinyu@stu.gdou.edu.cn"],"sample_collection_protocol":["Juvenile Eleutheronema tetradactylum were obtained from a commercial fish farm in Zhanjiang, China. Fish were acclimated at 28 degrees Celsius for one week in laboratory tanks. The water temperature was decreased gradually by 2 degrees Celsius per day and stabilized at 18 degrees Celsius for the cold-stress groups. Liver tissues were collected at three time points: 0 days (control group), 7 days, and 14 days after cold exposure. Three biological replicates were sampled per group. For metabolomics analysis, liver tissues were immediately snap-frozen in liquid nitrogen and stored at minus 80 degrees Celsius until metabolite extraction. Pooled quality control samples were prepared by mixing equal volumes of all liver sample extracts and were used to monitor analytical stability.
"],"omics_type":["Metabolomics"],"study_design":["Metabolomics","liver","untargeted analysis","liver metabolism","cold stress","Eleutheronema tetradactylum","Agilent 1290 Infinity LC","AB SCIEX TripleTOF 6600","antioxidant response","Elentheronema tetradactylum","experimental sample"],"curator_keywords":["Metabolomics","liver","untargeted analysis","liver metabolism","cold stress","Eleutheronema tetradactylum","Agilent 1290 Infinity LC","AB SCIEX TripleTOF 6600","antioxidant response","Elentheronema tetradactylum","experimental sample"],"mass_spectrometry_protocol":["Mass spectrometer: AB Sciex Triple TOF 6600. Ion source: Electrospray ionization (ESI). Ionization mode: Positive and negative modes. Source temperature: 600 C. Ion source gas 1: 60 psi, ion source gas 2: 60 psi, curtain gas: 30 psi. Ion spray voltage floating: plus 5500 V for positive mode and minus 5500 V for negative mode. MS scan range: m/z 60 to 1000 Da. MS/MS scan range: m/z 25 to 1000 Da. MS accumulation time: 0.20 seconds per spectrum. MS/MS accumulation time: 0.05 seconds per spectrum. Declustering potential: 60 V for positive and minus 60 V for negative. Collision energy: 35 V with a spread of plus/minus 15 eV. Acquisition mode: Information dependent acquisition (IDA) with data-dependent acquisition (DDA); maximum 10 fragment spectra per cycle.
"],"metabolite_name":["Methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate","Ponceau 6","Trans-3'-hydroxycotinine o-.beta.-d-glucuronide","(1r,2e,7r,10e,12s,13s,15r)-12,15-dihydroxy-7-methyl-8-oxabicyclo[11.3.0]hexadeca-2,10-dien-9-one","1(6h)-pyridazinebutanoic acid, 6-imino-3-(4-methoxyphenyl)-","Corilagin","(2-{[3-hydroxy-2-tetradecanamidooctadec-4-en-1-yl phosphonato]oxy}ethyl)trimethylazanium","Morphine n-oxide","Biphenylindanone a","Uroporphyrin iii","Tectorigenin","Methyl hexadecanoate","Cefuroxime","1h-indole-1-pentanoic acid, 3-(1-naphthalenylcarbonyl)-","1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'-sn-glycerol)","Loxistatin acid","N-acetyl-p-fluoro-dl-phenylalanine","Thr-Val-Leu","Kinetin","Arecoline hydrobromide","Bensulfuron-methyl","Ergonovine","Quizalofop","Isorangiformic acid","Reserpine","N-[4,5-dihydroxy-2-[[4-[hydroxy(phenyl)methyl]-5-oxo-3-phenyl-2h-furan-2-yl]oxy]-6-(methoxymethyl)oxan-3-yl]acetamide","Panobinostat","Uridine 5'-triphosphate","Anabaenopeptin a","Dihydrokaempferol","Ile-thr","Methyl 10-acetyloxy-4,5,9-trihydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate","Saikosaponin a","15(s)-15-methylprostaglandin e1","Lisinopril (8r,s)-diketopiperazine","(5s,8s)-8-benzoyl-2-[(z,1s,2s)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione","1-oleoyl-sn-glycerol 3-phosphate","Methyl 5,6-diacetyloxy-10-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,8-trioxo-4a,5,6,6a,9,10,10b,11-octahydronaphtho[1,2-h]isochromene-2-carboxylate","Propanoic acid, 2-[[4-[2-[[[(2,4-difluorophenyl)amino]carbonyl]heptylamino]ethyl]phenyl]thio]-2-methyl-","Propenyl thiosulfate (isomer of 107)","Calceolarioside a","Cauloside c","Mgmg 16:3","Pi(18:1/16,17-epdpe)","N-(3-hydroxyphenyl)arachidonoylamide","Gly-Gly","3-(1h-indol-3-ylmethyl)-6,18-dimethyl-12-(1-phenylethyl)-9,15-di(propan-2-yl)-1,4,7,10,13,16,19-heptazacyclotricosane-2,5,8,11,14,17,20-heptone","Dimethenamide esa","Gln-Gly-Gln","Sennoside b","Agnuside","1-stearoyl-2-oleoyl-sn-glycero-3-phosphocholine","Gedunin","Lusitanicoside","O-(desmorpholinopropyl)gefitinib","Spiro[3h-indole-3,3'-pyrrolidine]-1(2h)-acetic acid, 5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2',5'-trioxo-","D-erythro-sphinganine-1-phosphate","Maltitol",".beta.-d-glucopyranosiduronic acid, 5-[3-[(2,2,3,3-tetramethylcyclopropyl)carbonyl]-1h-indol-1-yl]pentyl","5'-(furan-3-yl)-4a-hydroxy-4,7-dimethylspiro[5,6,7,8a-tetrahydro-1h-naphthalene-8,3'-oxolane]-2,2'-dione","Secobarbital","Guanosine 5'-diphospho-.alpha.-d-mannose","Glucohirsutin","Phosphatidylcholine lyso 20:5","1,3-benzenediol, 4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1h-pyrazol-3-yl]-6-ethyl-","5,10-dimethoxy-2,2-dimethylpyrano[3,2-g]chromen-8-one","Cinchonine","1-(1-2r-phosphothiotidyl)inositol-3,4-bisphosphate","1-(9z-octadecenoyl)-sn-glycero-3-phospho-(1'-myo-inositol)","Lamivudine","L-theanine","1-palmitoyl-2-(4-ketododec-3-enedioyl)phosphatidylcholine","Phosphatidylcholine lyso 20:0","Phosphatidylcholine lyso 20:1","Laminaritetraose","Phosphatidylcholine lyso 20:2","3-hydroxycolensoic acid","Frangulin b","Hexylglutathione","Pinostrobin","His-Gly-His","Eudesmin","Harmane","N-(dodecanoyl)-1-.beta.-glucosyl-sphing-4-enine","D-Lyxose","1-oleoyl-2-stearoyl-sn-glycero-3-phosphocholine","5-(4-hydroxyphenyl)-5-phenylhydantoin","Xanthurenic acid","Cevadine","Saquinavir","Diflufenzopyr","1-pyrrolidineheptanoic acid, 2-[(1e,3s,4s)-3-hydroxy-4-methyl-1-nonen-6-yn-1-yl]-5-oxo-, (2r)-","5.alpha.-androstan-3.alpha.,17.beta.-diol-o-3-.beta.-glucuronic acid","(desmethyl)hydroxycerivastatin","Pi 40:7","Glycine, 1,1'-(1,8-dioxo-1,8-octanediyl)bis[glycyl-","Pi 40:8","Spiro[isobenzofuran-1(3h),9'-[9h]xanthen]-3-one, 3'-(4-aminophenoxy)-6'-hydroxy-","Tyr-Tyr-Tyr","Flavanone + 4o, 1prenyl","Crustecdysone","Penicillamine disulfide","Pi 40:6","Chymostatin","Linoleoylglycine","Arg-Ser-Arg","Naringin","Ala-Ala","Epanorin","Trans-traumatic acid","Lys-His","Paeonolide","Digitoxin","Fa 18:2+2o","Swietenocoumarin b","Pc 42:10","Pc 42:11","Trans-3,5-dimethoxy-4-hydroxycinnamaldehyde","Ala-phe","2-amino-3-({hydroxy[2-(icosanoyloxy)-3-[octadec-11-enoyloxy]propoxy]phosphoryl}oxy)propanoic acid","Thymidine 5'-diphosphate","Phosphatidylethanolamine lyso 20:5","13,14-dihydro-16,16-difluoroprostaglandin f2.alpha.","Androsterone glucuronide","Indole","Tepraloxydim","Fusidic acid","Arg-Pro","Phosphonic acid, p-[[4-[(1-oxotetradecyl)amino]phenyl]methyl]-","3-iodo-l-thyronine","Glucobrassicin","O,o-diethyl phosphate","Fumonisin b1","hydrocortisone 21-acetate","Fumonisin b2","[(1as,1bs,5s,5as,6s)-6-hydroxy-6-(hydroxymethyl)-2-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1ah-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate","Fumonisin b4","Leupeptin","Sulfasalazine","Blood group h trisaccharide","5-methyltetrahydrofolic acid","Gln-arg","Mef-glu","3-methoxyprostaglandin f1.alpha.","Estrone sulfate","Dihydroresveratrol","Thyrotropin-releasing hormone","Fosamine","Aschantin","N-propyl gallate","Pc 38:8","Linoleic acid","Sinefungin","4-hydroxyisophthalic acid","Pc 38:7","(2s)-2-[(2r,3s,7r,8r,8as)-2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]-3-methylbutanoic acid","Pc 38:6","N-2-hydroxyethylpiperazine-n-3-propanesulfonic acid","Tacrolimus","N-(1,3-dihydroxyoctadec-4-en-2-yl)tetradecanamide","Doxorubicinone","gamma-L-Glutamyl-L-valine","4-hydroxyphenylmaraviroc","9,10-dihydroxy-12z-octadecenoic acid","Dehydrocorydaline","Alpinetin","Melatonin","L-Phenylalanine","Benzenesulfonic acid, dodecyl(sulfophenoxy)-","Quercetin-3-o-vicianoside","Violacein","Candesartan","1,3,5(10)-estratrien-3,17.beta.-diol 17-glucosiduronate","Fahfa 36:0","Vulpinic acid","Fahfa 36:1","Fahfa 36:4","Methanone, (4-hydroxy-1-naphthalenyl)(1-pentyl-1h-indol-3-yl)-","6-hydroxymelatonin","Deoxysappanone b 7,3'-dimethyl ether","Oleanolic acid","Glutathione ethyl ester","Tremulacin","Hexsose-deoxyhexose + hexsose-deoxyhexose + c20h32","6-methoxyflavone","7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-ol","7-deacetoxy-7-oxokhivorin","S-lactoylglutathione","Phytanic acid","3-amino-1-propanesulfonic acid","3-bromophenol","Secoisolariciresinol diglucoside","N-Acetyl-L-tyrosine","Ile-Ile","Uracil 5-carboxylate","Threonine","Caudatin","5'-phosphoribosyl-5-amino-4-imidazolecarboxamide (aicar)","1h-indole-5-carboxylic acid, 1-[2-hydroxy-3-(4-phenoxyphenoxy)propyl]-3-(2-methyl-1-oxopropyl)-","2-Deoxyribose 5-phosphate","8-methylthiooctyl glucosinolate","Bestatin","Telmisartan","Lovastatin hydroxy acid","5-keto-d-gluconic acid","5(S)-HpETE","Pc(17:0/9-hode)","8-fluoro-2-(trifluoromethyl)quinolin-4-ol","Isomurolic acid","Curine","Eicosenoic acid","1-(1-octadecanoyl-2r-(5z,8z,11z,14z)-eicosatetraenoylphosphatidyl)inositol-3,4,5-trisphosphate","5,8,11,14-eicosatetraenoic acid, 16-hydroxy-, (5z,8z,11z,14z,16r)-","3-acetyl-11-keto-.beta.-boswellic acid","18.beta.-glycyrrhetinic acid","Steviolbioside","11-deoxy-16,16-dimethylprostaglandin e2","3-dehydrocholic acid","Aceroside viii","Quinoline-2,4-diol","5-heptenoic acid, 7-[(1r,2r,3s,5s)-2-[(1e,3s)-3-(2,3-dihydro-1h-inden-2-yl)-3-hydroxy-1-propen-1-yl]-3-fluoro-5-hydroxycyclopentyl]-, (5z)-","2-(4-hydroxyphenyl)ethyl (1s,4ar,7ar)-4a-hydroxy-7-methyl-5-oxo-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,6,7,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate","Erdosteine thioacid","1,2-distearoyl-sn-glycero-3-phospho-l-serine","Sanguinarine sulfate","6,8-dihydroxy-2,2,4,4-tetramethyl-7-(3-methylbutanoyl)-9-(2-methylpropyl)-9h-xanthene-1,3-dione","Trihydroxycholestanoic acid","3- quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxyphenyl)-7-(2- methoxyphenyl)-2-methyl-5-oxo-, 2-methoxyethyl ester","Coproporphyrin iii","Seleno-l-methionine","Cyclohexylaminopropanesulfonic acid","Enterostatin human","Ps(18:0/8,9-epete)","Tricoumaroyl spermidine","N-hydroxy-4-aminobiphenyl","Phosphatidylcholine lyso 17","Phosphatidylcholine lyso 18","1-methyladenosine","Pe 39:7","Perseitol","Pe 39:4","1,2-dipalmitoylphosphatidylinositol-4,5-diphosphonate","1,3,5(10)-estratrien-3,17.beta.-diol 17-sulfate","Ps(18:0/8,9-eet)","All-trans-4-ketoretinoic acid","Ala-Arg","(2e,6e,11e,13e)-18-(2,6-dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid","Etidronic acid","Cytidine 5'-diphosphate","[1,1'-biphenyl]-2-carboxylic acid, 4'-[[2,3-dimethyl-5-[[[(1s)-1-(4-nitrophenyl)ethyl]amino]carbonyl]-1h-indol-1-yl]methyl]-","Fipronil","Gyromitrin","Glutathione disulfide","N-acetylglutamine","Salicylic acid .beta.-d-o-glucuronide","Haploside c","Medicagenic acid","Plantamajoside","13s-hydroperoxy-9z,11e-octadecadienoic acid","2-hydroxybenzyl alcohol","Phytic acid","Octadecanoic acid","8s-hydroxy-4z,6e,10z-hexadecatrienoic acid","Quercetin 3,4'-di-o-glucoside","15-ketolatanoprost (free acid)","2-guanidinobenzimidazole","Stearic acid","(2-aminoethoxy)[2-[docosa-4.7.10.13.16.19-hexaenoyloxy]-3-[hexadec-1-en-1-yloxy]propoxy]phosphinic acid","Sakuranetin","Pc 17:0-14:1-d5","5-hydroxydiclofenac","Pe(16:0/9-hode)","Nitrilotriacetic acid","Thymol-beta-d-glucoside","(2r,3s,4s,5r,6r)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-5-[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol","Quassin","Methyl palmitoleate","Malonylhexsose + hexsose-deoxyhexose + c20h32","[(3r,4s,8s,8as)-3-hydroxy-6,8a-dimethyl-8-[(z)-2-methylbut-2-enoyl]oxy-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 4-hydroxybenzoate","Finasteridecarboxylic acid","N4-anisoyl-2'-deoxycytidine","2-[[6-[[17-[5,6-dimethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-1-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol","Lys-Tyr","3-cyclopentene-1-octanoic acid, 2-(3-hydroxy-1-penten-1-yl)-5-oxo-","Naltrindole","Mangiferin","Ascochlorin","Genistein","L-Cysteic acid","1-palmitoyl-2-arachidonoyl-sn-glycero-3-phosphoserine","4-methoxycyclohexanecarboxylic acid","D-myo-inositol-1,2,3,5,6-pentaphosphate","Hexosyl lpe 16:0","Tyr-Pro-Phe","3-o-p-hydroxybenzoyl ceanothic acid","P-toluenesulfonamide","Ethynylestradiol 3-.beta.-d-glucuronide","Gramine","Thymine","Acetyl isogambogic acid","Hydrocortisone 21-hemisuccinate","Farrerol","Ofloxacin","Benidipine","Pamidronic acid","1.alpha.-methyl-5.alpha.-androstan-3.alpha.-ol-17-one glucuronide","Flavopiridol","D-Ribose","Ps 39:6","Pc 34:4","Cyclic gmp","Val-met","Sinomenine","Pc 34:3","Trans-cinnamic acid","8-(p-chlorophenylthio)-cyclic-adenosinemonophosphate","Cer[np] t36:0","3',4',5,7-tetrahydroxy-3,6,8-trimethoxyflavone",".alpha.-L-Glu-Gly","Zinniol","Probucol","Mannose 6-phosphate","Met-Trp","Retreversine","1h-indole-1-pentanoic acid, 3-[(2,2,3,3-tetramethylcyclopropyl)carbonyl]-","Gly-Pro-Glu","Guanosine 3',5'-cyclic monophosphate","L-Threonine","Fahfa 32:1","D-Galactarate","Eprosartan","Pe(16:1e/14-hdohe)","4-(2-hydroxyethyl)piperazine-1-ethanesulfonic acid","L-Leucine","Pyridoxal","Dihydrogedunic acid, methyl ester","Febuxostat","N-Acetyl-Asp-Glu","Archangelicine","Pi(16:0/8,9-eet)","Salicin","Ps 38:6","Forskolin","Luteolin 7-glucoside","Methyl (4br,10ar,12as)-6-hydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-10b,11-dihydronaphtho[2,1-f]isochromene-4a-carboxylate","4'-hydroxyflavanone","DL-Homocystine","Methyl 2-benzamido-3-phenylpropanoate","Nitrocefin","Solanidine base + o-hex-dhex","Gibberellate","Ps 44:12","Fraxidin","Norepanorin","Indole-3-acetyl-l-valine","Icariside i","17-phenyltrinor-13,14-dihydroprostaglandin a2","17alpha-hydroxyprogesterone","N-tetracosenoyl-4-sphingenine","Ile-Gly-Ile","Dinor-12-oxophytodienoic acid","Orlistat","Phosphatidylethanolamine 24:4-22:6","Inosine 5'-monophosphate","Isoliquiritin","Geranylgeranyl pyrophosphate","Secoisolariciresinol","5-hydroxyrosiglitazone sulfate","Olopatadine","Neohesperidose","N2-isobutyryl-2'-deoxyguanosine","Sulochrin","N-acetyl-s-geranylgeranyl-l-cysteine","Blood group b trisaccharide","3,5-dinitrosalicylate","Olivetoric acid","Menaquinone 4",".alpha.-L-Glu-L-Asp","Famotidine","Furostane base -2h + o-hex","Pantothenate","Cyclohexanesulfamic acid","Pi 36:2","Pi 36:3","(phenoxymethyl)penicilloic acid","Pi 36:1","L-Valine","Lansoprazole","Pi 36:5","[17-acetyl-3-[5-[5-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-8,14,17-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthren-12-yl] benzoate","Pg 44:10","Rhein","Pg 44:11","Pg 44:12","4-({5-[5-hydroxy-3-({[(2z)-2-methylbut-2-enoyl]oxy}methyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl}methoxy)-4-oxobutanoic acid","Mycophenolic acid","Acetoxyvalerenic acid","1,2alpha-epoxydeacetoxydihydrogedunin","N-acetylhistamine","Minoxidil",".beta.-nicotinamide adenine dinucleotide(NAD)","17-phenyltrinor-8-iso-prostaglandin e2","1,2-dihexadecanoyl-sn-glycero-3-phosphate","Hematoxylin","Pc 42:7","Pro-Ala","17,20-dimethylprostaglandin f1.alpha.","Asp-Asp","Phenaceturic acid","Tyr-Asp","Asp-Asn","Pe 34:1","Cis-4,7,10,13,16,19-docosahexaenoic acid","Sm d34:1","Deferasirox","Cyanuric acid","1-oleoyl-sn-glycero-3-phosphoethanolamine","Pg 40:7","Pg 40:8","2-amino-3-({hydroxy[2-(icosanoyloxy)-3-(octadecanoyloxy)propoxy]phosphoryl}oxy)propanoic acid","Montelukast sulfoxide","1h-indole-1-butanoic acid, 3-(1-naphthalenylcarbonyl)-","Tyr-Arg","4-nitrocatechol","Hirsuteine","[3-[hydroxy-[2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-octadecanoyloxypropyl] octadecanoate","Ionomycin","D-Glucuronate","Dehydrotumulosic acid","Folate","Smiglaside c (not validated) + 1acetyl","Cyanidin 3-(2g-glucosylrutinoside)","1,4-d-xylobiose","Diosmin",".alpha.-d-galactose 1-phosphate","N-(4-hydroxyphenyl)arachidonoyl amide","N-acetyltryptophan","3-dehydroquinic acid","Dibutyryl-cgmp","Cumyluron","Propanedinitrile, 2-[[3-bromo-5-(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-","Olmesartan","4,7,8-trimethoxy-3,5-dimethylchromen-2-one","Isoleucine","Harmaline","Dicloxacillin","Catechin","Carbobenzyloxyglycylglycyl-l-norleucine","3-(3,3-dichloro-2-hydroxypropyl)-6,8-dimethoxyisochromen-1-one","G1s neuac(2-3) a","Trp-Ala","Canrenone","Pseurotin a","Lys-Met","Dikegulac acid","Handelin","3.beta.,7.alpha.-dihydroxy-5-cholestenoic acid","9h-xanthene-9-propanoic acid, .alpha.-amino-.alpha.-[(1s,2s)-2-carboxycyclopropyl]-, (.alpha.s)-","Guanosine 5'-diphospho-.beta.-l-fucose","Omeprazole","3,2'-dihydroxy-4,4',6'-trimethoxychalcone","3,5-dichlorosalicylic acid","Doxycycline","Arg-Thr","(e)-3-(4-acetyloxy-2,3-dihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1h-naphthalen-1-yl)prop-2-enoic acid","Rifaximin","8s,15s-dihydroxy-5z,9e,11z,13e-eicosatetraenoic acid","Aminopyralid","Andrastin c","Andrastin a","Rabelomycin","3,4-dihydroxybenzoic acid","4,4'-sulfonylbisphenol","7,8-dihydroxy-4-methylcoumarin","D-Maltose","L-serine, n-(1-oxohexadecyl)-o-phosphono-","Pyroglu-trp","D-glucosaminic acid","Fenhexamid","Thr-Arg","4'-demethylpodophyllotoxin","1-palmitoyl-2-arachidonoyl-sn-glycero-3-phosphocholine","2-despiperidyl-2-(5-carboxypentylamine)repaglinide","Beta-elemonic acid","20a,20b-dihomo-9-oxo-11r,15s-dihydroxy-5z,13e-prostadienoic acid","5-iodo-2'-deoxycytidine","Cypridinid luciferin","Isoschaftoside","Deoxyadenosine","Pc(15:0/8-hete)","Acetoxystachybotrydial acetate","4-hydroxyomeprazole sulfide","Prazosin","Epigallocatechin gallate","3,5-dihydroxybenzyl alcohol","1-(1z-hexadecenyl)-sn-glycero-3-phosphoethanolamine","Ps 34:2","16,16-dimethylprostaglandin a1","16,16-dimethylprostaglandin a2","4,6-diamino-5-formamidopyrimidine","Cholesta-4,6-dien-3-one","4-chlorophenoxyacetic acid","Met-Gly-Met","Sulpiride","Echinocystic acid","(3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-8-yl) acetate","Dulcoside a","Secoxyloganin","Oxymorphone 3-.beta.-d-glucuronide","Luteolin","Teniposide","Hydroxyphenyllactic acid","Adenosine 3',5'-cyclic phosphate (cAMP)","5-hydroxy-6e,8z,11z,14z,17z-eicosapentaenoic acid","Flucarbazone","Magnolol","Leiocarposide","Desmethylverapamil","3-hydroxykynurenine","Carapin","Acetyl-dl-leucine","12,13-dihydroxy-9z-octadecenoic acid","N-[tris(hydroxymethyl)methyl]-3-aminopropanesulfonic acid","Boldenone sulfate","2-phthalimidoglutaric acid","3-o-protocatechuoyl ceanothic acid","5.9-tetracosadienoic acid","N-carboxyethyl-.gamma.-aminobutyric acid","Spiro[3h-indole-3,3'-pyrrolidine]-1(2h)-acetic acid, 5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxo-","5-trans-latanoprost acid","Pi 32:1","Dimethenamid ethanesulfonic acid","Ethynylestradiol 17-.beta.-d-glucuronide","Adenylyl(3'-5')cytidine","Gemcitabine diphosphate","Aniline","Diclofop","Salvinorin a",".alpha.-guanidinoglutaric acid","Gelsemine","Pe(16:0/19,20-epdpe)","4'-hydroxymethyl-5'-desmethylmeloxicam","Glufosinate","Strophantidin","Dihomo-gamma-Linolenic Acid","Cypridinid luciferin enol sulfate","Cytidine 2',3'-cyclic phosphate","Indole-3-pyruvic acid","1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoric acid","Swertiamarin","Sm d30:1","Corydaline","Saikosaponin b2","Decahydrogambogic acid","Wedelolactone","Benzoic acid, 2-[[(2z)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propen-1-yl]amino]-3-hydroxy-","Tranilast","4-hydroxy-8-methoxy-5-methyl-3-(3-methylbut-2-enyl)chromen-2-one","Resveratrol 4'-o-d-glucuronide","Pg 44:8","Asn-Asp","[(2r)-2-[(e,2s,4r)-4,6-dimethyloct-6-en-2-yl]-6-oxo-2,3-dihydropyran-3-yl] (2e,4e,6s)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate","3-methyloxyindole","11.alpha.-hydroxyprogesterone .beta.-d-glucuronide","1h-indole-1-pentanoic acid, 3-[(4-chloro-1-naphthalenyl)carbonyl]-","Pyruvaldehyde","Dehydroabietamide","Desferrioxamine","N5-(1-iminobutyl)-l-ornithine","13,14-dihydro-15-ketotetranorprostaglandin f1.beta.","15-deoxy-delta-12,14-pgj2","Leucine","20-hydroxy-4z,7z,10z,13z,16z,18e-docosahexaenoic acid","Fosfomycin","Dihydrothymine","Val-Gln","N-palmitoyltaurine","Curcumin","16-phenyltetranorprostaglandin f2.alpha.","Aurantio-obtusin","Baicalin",".beta.-acetyldigoxin","Piperlongumine","Corosolic acid","Perifosine","Acetic acid, 2,2'-[oxybis(2,1-ethanediyloxy)]bis-","N-octanoylsphingosine-1-phosphate","6-Hydroxydopamine","7,7-dimethyl-(5z,8z)-eicosadienoic acid","Topotecan","Chloramphenicol glucuronide","Hexadecanedioic acid, 3,3,14,14-tetramethyl-","Nortrachelogenin","N-fructosyl s-(2-carboxypropyl)glutathione","Pc(16:1e/8,9-epete)","Trp-Asp","Indole-3-carboxylic acid","Irinotecan","Trp-Asn","Vitamin c","Hemslecin a","N-acetyl-l-phenylalanine","Estrone","Norbuprenorphine","Mestranol","1,2-dipalmitoyl-sn-glycero-3-phospho-(1'-myo-inositol)","Lumazine","Doxazosin","Periplogenin","Ramipril","Desmethylcerivastatin","Methylophiopogonanone a","1-methylxanthine","Planaic acid","Poricoic acid a","Aspartame","Pe 42:10","Glu-Leu","Pe 42:11","Terbacil","1,4-pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1e,4e)-","1-(1,2r-dihexadecanoylphosphothiotidyl)inositol-3,4-bisphosphate","5h-thieno[2,3-c]pyran-3-carboxylic acid, 2-[[(benzoylamino)thioxomethyl]amino]-4,7-dihydro-5,5-dimethyl-","Cortisol 21-sulfate","Mangostine","Pe(18:1/14-hdohe)","1h-indole-5-carboxylic acid, 3-(2-methyl-1-oxopropyl)-1-[2-oxo-3-(4-phenoxyphenoxy)propyl]-","3-glu-28-xyl(1-4)rha(1-2)ara medicagenic acid","Glabridin","Prostaglandin i2","Methanone, (4-hydroxyphenyl)(1-pentyl-1h-indol-3-yl)-","Flavone","Paraoxon","Acetic acid, 2-[4-[(5,6-diphenyl-2-pyrazinyl)(1-methylethyl)amino]butoxy]-","Dihydromyricetin","Nitecapone","Biotin","Salvianolic acid b","Rac-2-despiperidyl-2-aminorepaglinide","DL-tryptophan","Ampicillin","16-phenoxytetranorprostaglandin a2","3-methoxylimaprost","1h-imidazo[4,5-c]pyridine-6-carboxylic acid, 1-[[4-(dimethylamino)-3-methylphenyl]methyl]-5-(2,2- diphenylacetyl)-4,5,6,7-tetrahydro-, (6s)-","Neochlorogenic acid","Leukotriene e4 methyl ester","Ingenol","Fumagillin","Destruxin a","Feruloyl tyramine","Ginkgolide c","Umbilicaric acid","Aucubin","Feruloylguaiacyl hexoside","3-oxocholic acid","Desferrioxamine x1","Cerivastatin","Oleic acid","1-o-hexadecyl-2-o-acetyl-sn-glyceryl-3-phosphoryl(n,n,n-trimethyl)hexanolamine","6,8-diprenylnaringenin","Diadenosine pentaphosphate","1,2-di(4z,7z,10z,13z,16z,19z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine","N6-(4-methoxybenzoyl)adenosine","Benzoic acid, 4-[[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)amino]carbonyl]-","Thr-Gly-Thr","Propanoic acid, 2-[[4-[2-[[(cyclohexylamino)carbonyl](4-cyclohexylbutyl)amino]ethyl]phenyl]thio]-2-methyl-","Prostaglandin g2","[(1ar,1bs,2s,5as,6r,6as)-5a-hydroxy-1a-methyl-2-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1b,2,6,6a-tetrahydrooxireno[1,2]cyclopenta[4,5-b]pyran-6-yl] (2e,6s)-6-hydroxy-2,6-dimethylocta-2,7-dienoate","Pseudouridine","1-palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine","1-nonadecanoyl-sn-glycero-3-phosphocholine","alpha-D-Galactose 1-phosphate","N-trityl-l-homoserine","Isoflavone base + 1o, 1meo, o-hex+c7h12no","Madecassic acid","2'-o-methyladenosine","Pi(18:0/12-hepe)","Imidacloprid","Isoverbascoside","9-hydroxy-3,4-dihydroacridin-1(2h)-one","Fumonisin py4","3-(3'-o-malonyl)glu(1-4)glu-28-glu bayogenin","Propofol .beta.-d-glucuronide","Bisdemethoxycurcumin","3-hydroxybiphenyl","Prostaglandin d1","Prostaglandin d3","4-methylumbelliferyl .beta.-d-glucuronide","4-methoxyacridin-9-ol","Bromadiolone","Ketoprofen","N(6)-((aminoethylamino)carbonyl)methylphenyladenosine","Neomangiferin","[1,1'-biphenyl]-2-carboxylic acid, 4'-[[(1-oxopentyl)phenylamino]methyl]-","4'-hydroxychalcone","4-ethoxy-2-hydroxybenzophenone","Glycyrrhizic acid","Jatrorrhizine","D-allose","4-acetoxyphenol","Hexadecanedioic acid","Arenobufagin","Lys-Ile","Pseudoplacodiolic acid","Prostaglandin e2","Prostaglandin e1","Chicoric acid","Naringenin-4'-o-.beta.-d-glucuronide","Pemetrexed","Isorhynchophylline","Atropine sulfate",".beta.-alanine, n-[2-[(3-hexylphenyl)amino]-2-oxoethyl]-","Trans-cyclohexane-1,2-diol","Yohimbic acid","Rosamultin","Bendroflumethiazide","Phenol, 4-[4-(4-fluorophenyl)-5-(4-pyridinyl)-1h-imidazol-2-yl]-","[d-asp3,e-dhb7]-microcystin-rr","1-(1,2r-dihexadecanoylphosphatidyl)inositol-3,4-bisphosphate","[5-hydroxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate","Isogentisin","Propanoic acid, 3-[[[2-[(aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-","N-succinyl-5-aminoimidazole-4-carboxamide ribose","Spiculisporic acid","[4,5-dihydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1h-naphthalen-1-yl] hexanoate","Cymarin","Ala-Met","Aurapten","Ethyl 4-hydroxy-7-(trifluoromethyl)quinoline-3-carboxylate","Prostaglandin b2","Isopentenyladenine","Phytosphingosine 1-phosphate","Reserpic acid","N-arachidonoyl-l-alanine","Cyclic adenosine diphosphate ribose","Pg 36:3","Pg 36:5","N-benzyloxycarbonylglycine","Gly-His","Kaempferitrin","(.+/-.)-11-nor-.delta.9-tetrahydrocannabinol-9-carboxylic acid","Thiocolchicoside","Phosphatidylethanolamine lyso alkenyl 16:0","6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic acid","Glycochenodeoxycholate","D-ribulose 5-phosphate","2-tert-butyl-6-methylphenol","N-(1,1-dimethyl-2-hydroxyethyl)-3-amino-2-hydroxypropanesulfonic acid","Dexanabinol","Malonylhexsose + malonylhexsose-deoxyhexose + c20h32","2-amino-3-[hydroxy-[2-hydroxy-3-[octadec-9-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid","Glu-Trp","Argininosuccinic acid","Pc 17:0-22:4-d5","Pro-his","N-(phosphonomethyl)glycine","Spirostane -2h, + 1o, o-pen-dhex","5-hexenoic acid, 6-[(2r,3s)-3-[[[(4-chloro-2-methylphenyl)sulfonyl]amino]methyl]bicyclo[2.2.2]oct-2-yl]-, (5z)-","3-(1h-indol-3-ylmethyl)-6,18-dimethyl-9-(2-methylpropyl)-12-(1-phenylethyl)-15-propan-2-yl-1,4,7,10,13,16,19-heptazacyclotricosane-2,5,8,11,14,17,20-heptone","Mannose","Glucose","Ethanone, 1-[2-hydroxy-3-propyl-4-[4-(2h-tetrazol-5-yl)butoxy]phenyl]-","3-hydroxystanozolol glucuronide","Glycylproline","5.beta.-androst-1-en-17.beta.-ol-3-one glucuronide","(2r,3r,3ar,5r)-5,7-dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-3a-prop-2-enyl-2,3,4,5-tetrahydro-1-benzofuran-6-one","Ophthalmate","Cortexolone","Leu-Ala","1-(1,2r-dioctanoylphosphatidyl)inositol-3,4-bisphosphate","9-cis-retinal","15-deoxy-.delta.12,14-prostaglandin j2 glutathione","4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone n-.beta.-d-glucuronide","3,5,7,3',4'-pentahydroxyflavanone","Polyphyllin e","Spectinomycin","Urocanic acid","Albendazole sulfone",".alpha.-hederin","Phosphatidylethanolamine (16:0/16:1) abbr:ppope","Cinnavalininate","Amoxicillin","Calpain inhibitor ii","D-erythrose 4-phosphate","1-(1,2-dihexanoylphosphatidyl)inositol-5-phosphate","Acadesine (drug)","Glutamic acid","Valsartan","(2r,4'ar,5's,6'r,6'as,10'ar,10'br)-6'-(acetyloxy)-4'a,6'a,10'b-trimethyl-5''-oxo-decahydro-1'h-dispiro[oxirane-2,7'-naphtho[2,1-b]pyran-3',3''-oxolane]-5'-yl 2-methylpropanoate","Galactonic acid","Methyl (4s,5z,6s)-4-[2-[[(1s,2r,3r,5r)-5-(1,3-dihydroxypropan-2-yl)-3-hydroxy-2-methylcyclopentyl]methoxy]-2-oxoethyl]-5-ethylidene-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4h-pyran-3-carboxylate","Oxaprozin","Olmesartan medoxomil","Prunasin","L-leucine, n-acetyl","Carbamic acid, n-[4-[3-[[[7-(hydroxyamino)-7-oxoheptyl]amino]carbonyl]-5-isoxazolyl]phenyl]-, 1,1-dimethylethyl ester","Thiorphan","Oleandrin","Ipecoside","Pi(17:0/18-hepe)","(methylsulfinyl)octyl glucosinolate","Nocardamine","Tetrahydroalstonine","Piriprost","1,2-benzenedicarboxylic acid","7-keto-3.alpha.,12-.alpha.-dihydroxycholanic acid","N-palmitoyl-d-sphingosine","Valine","1-palmitoyl-2-linoleoyl-sn-glycero-3-phospho-(1'-rac-glycerol)","7-hydroxyfluphenazine","Gibberellic acid","Pc(16:1/17-hdohe)","15s-hydroperoxy-11z,13e-eicosadienoic acid","Glp-Trp-Oet","Disialyllactose","5,8-dihydroxy-1,4-naphthoquinone","Nicotinamide ribotide","Phosphatidylethanolamine lyso alkenyl 18","(2r,3s,4s,5r,6s)-2-[[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-(3,4,5-trimethoxyphenoxy)oxane-3,4,5-triol","Itaconic acid","Neobavaisoflavone","Guanosine 5'-diphosphate","Jujuboside b","L-Alanine","Pc(14:0/20-hdohe)","D-erythro-imidazolylglycerol phosphate","[(4e)-7-acetyloxy-6-hydroxy-2-methyl-10-oxo-2,3,6,7,8,9-hexahydrooxecin-3-yl] (e)-but-2-enoate","Pratensein","Mitoxantrone","1-(5z,8z,11z,14z-eicosatetraenoyl)-sn-glycero-3-phosphoserine","3'-hydroxyrepaglinide","Propanoic acid, 2-[[1-[3-[4-([1,1'-biphenyl]-4-ylcarbonyl)-2-propylphenoxy] propyl]-1,2,3,4-tetrahydro-5-quinolinyl]oxy]-2-methyl-","--",".alpha.-L-Asp-L-Phe","Lotaustralin","Kanamycin a","Pe 38:6","16-phenoxytetranorprostaglandin e2","L-homocystine","Platensimycin","Furosemide","Enrofloxacin","7.alpha.-hydroxy-3-oxo-4-cholestenoic acid","Nonanamide, n-[(4-hydroxy-2-iodo-5-methoxyphenyl)methyl]-8-methyl-","Fipronil sulfone","Pc 35:5","Morphine-3-glucuronide","Phosphoserine","Suxibuzone","Alfuzosin","Canavanine","Prostaglandin j2","3,4-dihydroxyhydrocinnamic acid","Virginiamycin component a","Rac-4-sulfoxypropranolol","4-(trifluoromethyl)quinoline-2,7-diol","Virginiamycin component b","Val-Leu","Licoricidin","1-myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine","(3s,4r,4as)-3-[(2s,3r,4s,5s,6r)-6-[[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-ethenyl-4,4a,5,6-tetrahydro-3h-pyrano[3,4-c]pyran-8-one","O-phospho-l-threonine","Citiolone","(+)-6-aminopenicillanic acid","Iloprost","Limaprost","Karakin","Anorexigenic peptide","1-stearoyl-2-oleoyl-sn-glycero-3-phospho-(1'-sn-glycerol)","Bentazon","Guanosine 5'-monophosphate","Caperatic acid","Pc(18:0/9-hode)","Quinate","5,7-dihydroxy-2-phenyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one","3,15-dibenzyl-1,4,12-trimethyl-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone","3-thiatetradecanoic acid","Flecainide","Anthranilic acid","Difenacoum","Ile-Asp","Allantoin","7,8-dihydrobiopterin","Dapsone","1-hexadecyl lysophosphatidic acid","Formylanthranilic acid","Pc 17:0-18:1-d5","N4-acetyl-2'-O-methylcytidine","N-(dodecanoyl)sphing-4-enine","12:4+4o fatty acyl hexoside","Phosphatidylethanolamine alkenyl 18:0-20:5","Sucralose","Dihydrofolic acid","Rosmarinate","Lewis a trisaccharide","Enalapril","Phenylglucoside","L-Saccharopine","Pi(16:0/8,9-epete)","5-Hydroxytryptophan","Benzo[h]quinoline-3-carboxylic acid, 1,4-dihydro-4-oxo-","Sparfloxacin","11-nor-9-carboxy-.delta.9-tetrahydrocannabinol","Bacopaside ii","1h-indole-1-propanoic acid, 3-(1-naphthalenylcarbonyl)-","Gly-Leu","Imazapic","Picfeltarraenin ib","1-decanoyl-2-hydroxy-sn-glycero-3-phosphocholine","2'-deoxycytidine 5'-monophosphate","Pi 35:2","4-[(e)-3-[(2r,3r,4s,5s,6r)-3-[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one","Fostriecin","Cholesteryl sulfate","Osajin","Val-His","Phosphatidylcholine lyso 16:1","Podophyllotoxin","Methanone, (1-butyl-6-hydroxy-1h-indol-3-yl)-1-naphthalenyl-",".beta.-alanine, n-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3h-3-benzazepin-3-yl)-4-pyrimidinyl]-","Vanillic acid + o-sulfonatehex","D-Mannose","Bis(2-hydroxy-1-naphthyl)disulfide","Daunorubicin","Hexosyl lpe 18:3","Ginnalin a","Lariciresinol","2,2'-methylene-bis(6-tert-butyl)-4-ethylphenol","18alpha-glycyrrhetic acid","Beta-hydroxybutyrate","Creatinol o-phosphate","Zoledronic acid","Dfplnnh","L-cystine","Pentadecanoic acid","3-[(2r,3s,4r,6r)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-4-hydroxy-6-[(4e,6e,9z)-3-hydroxy-8-(hydroxymethyl)-2,6,10,12-tetramethyloctadeca-4,6,9-trien-2-yl]pyran-2-one","Glu-Gln","N-(2,4-dinitrophenyl)-l-leucine","Casticin","L-fucose-1-phosphate","4-heptenoic acid, 7-[(1r,2r,5s)-5-([1,1'-biphenyl]-4-ylmethoxy)-2-(4-morpholinyl)-3-oxocyclopentyl]-, (4z)-rel-","Medicagenic acid base + o-hexa","5-fluorocytidine","Guanosine 5'-monophosphate (GMP)","Flutamide","7.alpha.,17.alpha.-dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol glucuronide","(+)-catechin","gamma-Glutamyl-L-methionine","Chrysomycin b","Flavone base + 3o, 2meo, o-guaiacylglycerol-hex","1,4-bis[(p-hydroxyphenethyl)amino]anthraquinone","3',5'-dimethoxy-3,5,7,4'-tetrahydroxyflavone","Ile-Pro-Ile","Indolelactic acid","3,4-dihydroxybenzophenone","Taurocholate","2,4,5-trichlorophenol","Unoprostone","Maltotetraose","Aprobarbital","(2s,3r,5r,10r,13r,14s,17s)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2r,3r,5r)-2,3,6-trihydroxy-5,6-dimethylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-6-one","Dehydrocholic acid","Fluvastatin","Germinaline","Harpagoside","Fisetin","4-hydroxybenzaldehyde","(3,4,5-trihydroxy-6-methyloxan-2-yl) 2-(methylamino)benzoate","2-[[5-[[2,12-dihydroxy-4,4,10,13,14-pentamethyl-17-(1,5,6-trihydroxy-6-methylheptan-2-yl)-2,3,5,6,7,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-3-yl]oxy]-3-hydroxy-3-methyl-5-oxopentanoyl]amino]acetic acid","Quinine","3-hydroxypropyl-glucosinolate","Benserazide","Isoimperatorin","Deacetylgedunin","Myristic acid","Atractyloside a","Idarubicin","Bergaptol","Indomethacin","Triadimefon","2,4-dinitrophenol","Gly-Trp","Butachlor esa","1,3-benzenedisulfonic acid, 4-[2-[4-formyl-5-hydroxy-6-methyl-3-[(phosphonooxy)methyl]-2-pyridinyl]diazenyl]-","L-homocitrulline","(5s)-5-hydroxy-1,7-diphenylheptan-3-one","2'-fucosyllactose","Jasmonate","Ginsenoside-rc","Resveratrol","Cicaprost","Trans-crocetin","Nateglinide","Pyrenophorol","Caftaric acid","Urushiol i","Raddeanin a","Phlorobenzophenone","Chlorogenic acid","Gibberellin a20","9s-hydroperoxy-10e,12z-octadecadienoic acid","Cortisone","N5-(1-imino-3-butenyl)-l-ornithine","Phe-asp","Verbascose","1,3,7-trimethyluric acid","Hydroquinidine","Artemisin","Phosphatidylcholine 16:1-22:6","Ailanthone","Netilmicin sulfate","Didanosine","2,5,7,8-tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman","Diflubenzuron","Isomuronic acid","Quinacrine","Methyl 3-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-2-[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl]-4-methoxy-5-oxofuran-2-carboxylate","Rac-n,n-didesmethyl-o-desmethylvenlafaxine glucuronide","Gartanin","Ouabain","7-deacetylkhivorin","Syringetin 3-glucoside","Pregnenolone","Cytidine monophosphate n-acetylneuraminic acid","Carnosol","2'-Deoxyinosine 5'-monophosphate","Gentiopicroside","Leptomycin b","Prostaglandin f2.alpha.","Ethyl 8-fluoro-4-hydroxyquinoline-3-carboxylate","Ellagic acid","Methotrexate","Pantethine","[(2r,3r,4r,5r,6r)-2-[[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-4-[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-3-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxyoxan-3-yl] (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate","Np-000004(11)","5,8,11-eicosatriynoic acid","Benzoic acid, 3-[[(3-carboxycyclohexyl)amino]carbonyl]-4-[3-[4-[4-(cyclohexyloxy)butoxy]phenyl]propoxy]-","[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3as,6z,10e,11ar)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate","D-(-)-tagatose","Fa 9:1+1o","1-octadecanoyl-sn-glycero-3-phospho-(1'-myo-inositol)","Octanoic acid, 4-[(1-oxo-7-phenylheptyl)amino]-, (4r)-","4-hydroxy-2,2',3',5',6'-pentachlorobiphenyl","Nonanoic acid","Maltotriose","Polygalic acid","Prostaglandin a2","Soyasapogenol b base + o-hexa-hex-pen, o-c6h7o3(ddmp)","Bucladesine","Lucidenic acid f","Tetranorprostaglandin j2","5alpha-carboxystrictosidine","Homocitrate","2-hydroxy-5 (6)epoxy-tetrahydrocaryophyllene","L-alaninamide, n-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methyl-1-oxopentyl]-3-methyl-l-valyl-n-(2-aminoethyl)-","Maslinic acid","1-deoxy-d-xylulose 5-phosphate","[3-hydroxy-1-(4-methoxy-7-oxofuro[3,2-g]chromen-9-yl)oxy-3-methylbutan-2-yl] (e)-2-methylbut-2-enoate","7-[(6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1h-naphthalen-1-yl)methoxy]chromen-2-one","4-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (e)-3-(4-hydroxyphenyl)prop-2-enoate","Ginsenoside compound k","Oxytetracycline","Jasplakinolide","Trp-Met","Vitexin 4-o-glucoside","2-[3-[(e)-6-acetyloxy-2-hydroxy-6-methyl-3-oxohept-4-en-2-yl]-6-(carboxymethyl)-2-hydroxy-3a,5a,9b-trimethyl-5-oxo-2,3,4,6,9,9a-hexahydro-1h-cyclopenta[a]naphthalen-7-yl]-2-methylpropanoic acid","Dynasore","Saponarin","Agelasine (stereochemistry of diterpene unknown)","(2-acetyloxy-3,6-diphenylcyclohexyl) acetate","Pinolidoxin","Benzoic acid, 3-[[(3-carboxycyclohexyl)amino]carbonyl]-4-[3-[4-(4-phenoxybutoxy)phenyl]propoxy]-","Ergosterol","Higenamine","2,5-cyclohexadiene-1,4-dione, 3-hydroxy-2-[(1r,6r)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl-","Isomaltose","Bithionol","1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate","S-Adenosylmethionine","Fraxin","Dl-3,4-dihydroxyphenyl glycol","Betamethasone 21-acetate","Fluometuron","Olivetonide","Picloram","Deoxyguanosine","1,2-dilinolenoyl-sn-glycero-3-phosphoethanolamine","8-o-acetylharpagide","Furostane base -1h2o + 1o, o-hex, o-hex-hex","Trans-aconitic acid","Methylprednisolone succinate","Guaiazulene","14-((4-methoxyphenyl)diphenylmethoxy)daunomycinone","Octanediamide, n1-hydroxy-n8-[4-[4-[(1-oxo-5-hexyn-1-yl)amino]benzoyl]phenyl]-","D-neopterin","6-hydroxyflavanone","Constictic acid","2,4-dinitrotoluene","Naproxen","Onopordopicrin","Thieno[2,3-b]pyridine-5-carbonitrile, 6,7-dihydro-4-hydroxy-3-(2'-hydroxy[1,1'-biphenyl]-4-yl)-6-oxo-","Estriol 16alpha-(beta-d-glucuronide)","Androsterone sulfate","Ltc4-[d5]","Thromboxane b2","Cidofovir","Pe(16:1e/13-hode)","Pg 32:1","Nimodipine","4-[[4-hydroxy-2-(2-methylpropyl)-1-oxo-3,3a-dihydro-2h-imidazo[1,2-a]indol-4-yl]methyl]-1-methyl-2,4-dihydro-1h-pyrazino[2,1-b]quinazoline-3,6-dione","(2-aminoethoxy)[2-[hexadec-9-enoyloxy]-3-[octadeca-1.11-dien-1-yloxy]propoxy]phosphinic acid","5,7-dimethoxyflavone","Methanesulfonamide, n-[4-[[1-[2-(6-methyl-2-pyridinyl)ethyl]-4-piperidinyl]carbonyl]phenyl]-","Noroxymorphone","Benzoic acid + 1o, 1meo, o-hex","Rac-trans-3-hydroxy-1-methyl-2-pyrrolidinone-5-(3-pyridinyl)carboxylic acid","Methanone, [1-(4-hydroxypentyl)-1h-indol-3-yl](4-hydroxyphenyl)-","Protoporphyrin ix","Leonurine","2,2-bis(3-allyl-4-hydroxyphenyl)propane","D-glucarate","Phosphonic acid, p-[2-[3-[[(1-benzoyl-4-piperidinyl)methylamino]carbonyl]-2-naphthalenyl]-1-(1-naphthalenyl)-2-oxoethyl]-","Pentagastrin","1-hydroxy-2-naphthoic acid","N-oleoyl-n-methyltaurine","N-phenyl[(9,11,13-trimethyl-8,15-dioxatetracyclo[10.2.2.0<2,7>.0<9,14>]hexadec a-2(7),3,5-trien-12-yl)methoxy]carboxamide","Roburic acid","Allantoic acid","D-fructose","16-hydroxyhexadecanoic acid","Tridecanoic acid (Tridecylic acid)","Sm d40:2","1-stearoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine","Gly-Tyr","Pg 32:2","Carbenoxolone","2-[[1-(4-nitrobenzoyl)pyrrolidine-2-carbonyl]amino]benzoic acid","15-ketofluprostenol",".beta.-d-glucopyranosiduronic acid, 6-[3-(1-naphthalenylcarbonyl)-1h-indol-1-yl]hexyl","L-Carnosine","Coralyne chloride","Pomiferin","Girinimbine","3-deoxy-d-glycero-d-galacto-2-nonulosonic acid","Succinic acid n,n-dimethylhydrazide","Isopentenyladenosine","DL-serine","[3-(13-methyltetradecyl)-5-sulfooxyphenyl] hydrogen sulfate","1-palmitoyl-2-docosahexaenoyl-sn-glycero-3-phospho-(1'-rac-glycerol)","3'-AMP","Clozapine","Imazethapyr","Actinonin","Salazinic acid","N-acetylhistidine","Ochrephilone","Cer[ns] d33:1","Chrysin","Lobaric acid","6,7-dimethylesculetin","Dinoseb","[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate","Domperidone","2,3,4',5-tetrahydroxystilbene 2-glucoside","Schaftoside","Salmeterol","Cylindrospermopsin","Phosphatidylcholine alkenyl 16:0-22:6","N-(octadecanoyl)sphing-4-enine-1-phosphocholine","Agaric acid","5-(tetradecyloxy)-2-furoic acid","Ciprofibrate","Furostane base -1h2o -2h + 1o, o-hex, o-pen-dhex","Coumestrol","Pectolinarigenin","Arg-cys","Syringaresinol","Steganacin","1-piperazineacetic acid, 4-(phenylmethyl)-, 2-[[2-hydroxy-3-(2-propen-1-yl)phenyl]methylene]hydrazide","Cefaclor","(1-acetyloxy-3-hydroxy-6,8a-dimethyl-7-oxo-3-propan-2-yl-2,3a,4,8-tetrahydro-1h-azulen-4-yl) 4-hydroxybenzoate","Lasalocid","Astrasieversianin xv","Monensin","Pe(18:1/10-hdohe)","Oleuropein aglycone","4-pregnen-17.alpha., 20.beta.-diol-3-one-20-sulfate","1a,1b-dihomoprostaglandin e1","D-erythro-sphingosine-1-phosphate","Imazapyr","6-azauridine","Capric acid","2,6-di-tert-butylphenol","(e,2s,3r)-5-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-4-ene-2,3-diol","4-androsten-17.beta.-ol-3-one glucosiduronate","Pi(18:0/16,17-epdpe)","Deacylgymnemic acid","D-pinitol","Suramin","Tienilic acid","Lipoxin a4","Thymidine 5'-triphosphate","3'-hydroxyflavone","Benzyl succinate","Spirostane + 1o, -2h, o-hex-dhex-dhex","Speciosine","N-[tris(hydroxymethyl)methyl]-3-amino-2-hydroxypropanesulfonic acid","Demethoxycurcumin","Gangaleoidin","1,2-dipalmitoyl-sn-glycero-3-phospho-(1'-rac-glycerol)","Eurycomalactone","Rhodocladonic acid","Silybin","2-hydroxy-6-methylquinoline-3-carbaldehyde","Ser-Glu","6-[4,5-dihydroxy-6-methyl-3-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one","Pentasaccharides (hex-hex-hex-hex-hex)","[3-[octadec-11-enoyloxy]-2-(octadecanoyloxy)propoxy]phosphonic acid","Glutathione","6-bromoquinolin-3-ol","Pc(14:0/18-hete)","4-hydroxymandelonitrile","[(2e,6z,10z)-7,11-bis(acetyloxymethyl)-3,15-dimethylhexadeca-2,6,10,14-tetraenyl] acetate","Dl-4-hydroxy-3-methoxymandelic acid","Loxoprofen",".alpha.-amanitin","Pc 36:6","4-hydroxy-2',5'-dichlorobiphenyl","Pc 36:5","Pyridoxal (Vitamin B6)","N.omega.-nitro-l-arginine","Kainic acid","(3s,6r,6as,7s)-6,6a,7,8-tetrahydroxy-3-methyl-3,4,5,6,7,12a-hexahydro-2h-benzo[a]anthracene-1,12-dione","Etodolac","1h-indole-1-pentanoic acid, 3-[[[1-(aminocarbonyl)-2,2-dimethylpropyl]amino]carbonyl]-","Glycerol 3-phosphate","Alisol a 24-acetate","5-[(3s,8r,10r,13r,14s,17r)-3-[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one","Gln-tyr","(2r,3s,4s,5r,6r)-2-[[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[4-(4-hydroxyphenyl)butan-2-yloxy]oxane-3,4,5-triol","Pristanic acid","Erucic acid","NCGC00169011-01","5-methoxydimethyltryptamine","Pipemidic acid","Ala-Trp","6-[(3e,6e)-2,5-dihydroxy-4,6-dimethyl-7-(1,2,4-trimethyl-3,6-dioxabicyclo[3.1.0]hexan-4-yl)hepta-3,6-dien-2-yl]-4-methoxy-3,5-dimethylpyran-2-one","1,2,3,4,6-pentagalloyl .beta.-d-glucose","19,20-dihydroxy-4z,7z,10z,13z,16z-docosapentaenoic acid","11-(6-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-chloro-1,3,5-triazin-2-yl)-7,11- diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one","Flurbiprofen","21-carboxylic acid triamcinolone acetonide","21-Hydroxypregnenolone","2-hydroxy-4-methoxy-3,5-bis(3-methylbut-2-enyl)-6-(2-phenylethyl)benzoic acid","2'-hydroxy-2,3,4'-trimethoxychalcone","4-[[2-[(e)-1-hydroxybut-2-enyl]-5-oxooxolan-3-yl]amino]benzoic acid","Alpha-collatolic acid","15-cyclohexylpentanorprostaglandin f2.alpha.","1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoserine","N-acetyl-d-glucosamine 6-phosphate","D-(+)-mannose","Acetylaniline","Desethyleneciprofloxacin","Biflavonoid-flavone base + 3o and flavanone base + 2o + 1meo","Propanil","Mgmg 18:2","Acetic acid, 2-(4-chloro-2-methylphenoxy)-","Mgmg 18:3","Bavachin","Cyclopentanehexanoic acid, 2-[(2z)-4-carboxy-2-buten-1-yl]-3,5-dihydroxy-.gamma.-oxo-, (1r,2r,3s,5s)-","Divaricatic acid","1,2-dimyristoyl-sn-glycero-3-phosphate","Tyr-Gln","Alpha-dihydrogedunol","1-palmitoyl-2-hydroxy-sn-glycero-3-phospho-(1'-rac-glycerol)","[(2r,3r,4s,5s,6r)-3-acetyloxy-2-(acetyloxymethyl)-5-hexanoyloxy-6-[(2s,3r)-2,3,4-trihydroxybutoxy]oxan-4-yl] 14-hydroxytetradecanoate","Altanserin","1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-.alpha.,.alpha.- dimethyl-5-(1-methylethyl)-1h-indole-2-propanoic acid","Tyr-Glu","3,7-Dimethyluric acid","1-(9z,12z-octadecadienoyl)-2-hydroxy-sn-glycero-3-phosphoethanolamine","Oligomycin b","Florfenicol","Melphalan","Thiopental","3-ketofusidic acid","Aloesin","Sarmentoside b","Fraxetin","Gdp-l-fucose","1,5-anhydro-d-sorbitol","Colupulone isomer (mse)","Nitrendipine","Phosphatidylcholine lyso 22:6","Etoposide","Ps(18:1/16,17-epdpe)","Asp-Gln","(3r)-5-methyl-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[[4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methoxycarbonyl]hexanoic acid","Uric acid","Cyclopiazonic acid","1-behenoyl-2-hydroxy-sn-glycero-3-phosphocholine","Araloside a","Strophanthidinic acid lactone acetate","2,3-dinorfluprostenol","Matairesinol","Methyl 2-[(4ar,5r,6r,7s,8ar)-8a-ethenyl-5,7-dihydroxy-4-methylidene-3-oxo-1,4a,5,6,7,8-hexahydroisochromen-6-yl]prop-2-enoate","Benazepril","6-hydroxyflavone","Acephate","(2s)-8-[(e)-3-hydroxy-3-methylbut-1-enyl]-5,7-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one","DL-threonine","Daidzin","3,5,9-trioxa-4-phosphatetracosan-1-aminium, 7-(acetyloxy)-24-carboxy-4-hydroxy-n,n,n-trimethyl-, inner salt, 4-oxide, (r)-","(-)-secoisolariciresinol","Trp-Glu","Stearidonic acid","Argatroban","Ala-Leu","Dgmg 18:3","Trp-Gly","Flutolanil","Tetradecanedioic acid","Aripiprazole","Astragaloside iv","Hydroxysebacic acid","Phenol, 4-[2-[[2-benzo[b]thien-3-yl-9-(1-methylethyl)-9h-purin-6-yl]amino]ethyl]-","D-glucono-1,5-lactone","Ecgonine","Methyl (4s,5z,6s)-5-(2-hydroxyethylidene)-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4h-pyran-3-carboxylate","14,15-dihydroxy-5z,8z,11z,17z-eicosatetraenoic acid","Tazarotenic acid sulfoxide","Resazurin","Isoxanthohumol","Ginsenoside ro","2'-hydroxy-4'-methoxyacetophenone","Batimastat","Pc(16:0/14,15-eet)","Lithosprmoside","Quinone","17-phenyltrinorprostaglandin e2","Thr-Lys","Tricin methyl ether","5-methoxyindoleacetate","3',4'-methylenedioxyorobol","Bonactin","Aphyllic acid","Uridine 5'-diphosphoglucuronic acid (UDP-D-glucuronate)","Valeric acid","Hydramethylnon","1-oleoyl-l-.alpha.-lysophosphatidic acid","4-(2-hydroxyethyl)piperazine-1-(2-hydroxypropanesulfonic acid)","Lupulone","O-phosphoethanolamine","Pumiloside","Trh, free acid","Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo-","Phosphatidylethanolamine 22","Farnesyl pyrophosphate","Phosphatidylethanolamine 20","17-phenyltrinorprostaglandin d2","Pygenic acid c","Tetradec-5-ynoic acid","Rosuvastatin","Bispyribac","9-hydroxy-9-[[(e)-2-(hydroxymethyl)-3-[3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoyl]oxymethyl]-1-oxo-6-propan-2-yl-3,5a,6,7,8,9a-hexahydro-2-benzoxepine-4-carboxylic acid","Sb 205607","Guanine","Pe(18:0/19,20-epdpe)","(2e,4e)-12-[(10e,12e)-13-carboxy-3-[(2e,4e)-13-carboxy-12,14-dihydroxy-3,5,7-trimethyltetradeca-2,4-dienoyl]oxy-2-(hydroxymethyl)-8,10,12-trimethyltrideca-10,12-dienoyl]oxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid","Asp-Trp","4-hydroxy-3,5-dichlorobiphenyl","Flavone base + 3o, c-pen, c-pen","Amisulpride n-oxide","Udp-n-acetylglucosamine","5alpha-Androstane-3,17-dione","Acetyl phosphate","Apigenin 7,4'-dimethyl ether","4',5,7-trihydroxy 3,3',6,8-tetramethoxyflavone","Dehydrocostus lactone","Thalsimidine","Eriodictyol","Adefovir monopivoxil","7-o-benzylluteolin","Myo-inositol","4,6-dinitro-o-cresol","Xanthosine","3-formylrifamycin","Lithospermic acid","Myriocin","Retinol","2,4-thiazolidinedione, 5-[[5-(4-fluoro-2-hydroxyphenyl)-2-furanyl]methylene]-, (5z)-","8-bromoadenosine-cyclic-monothiophosphate","Atrazine","Methanone, (4-ethyl-1-naphthalenyl)(5-hydroxy-1-pentyl-1h-indol-3-yl)-","Fahfa 38:5","Glabrol","Orcinol gentiobioside","Palatinose","1h-indole-3-carboxylic acid, 1-[2-(2,5-dimethylphenoxy)ethyl]-","Zolmitriptan","Gln-his","Benzamide, 3-(dimethylamino)-n-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]-","4-[2-[(2-ethyl-2,3-dihydroxybutanoyl)oxymethyl]anilino]-4-oxobutanoic acid","Ala-asp","5-phospho-d-ribose 1-diphosphate","[2-[4-hydroxy-2,5-bis(hydroxymethyl)-3-(3-methylbutanoyloxy)oxolan-2-yl]oxy-6-(hydroxymethyl)-4,5-bis(2-methylpropanoyloxy)oxan-3-yl] decanoate","Inosine 5'-monophosphate (IMP)","Pravastatin","13-alpha-(21)-epoxyeurycomanone","Eicosapentaenoic Acid","Desmethyleneparoxetine","Pc(17:1/9-hode)","Bisphenol a","Bosentan","1-(1,2-dihexadecanoylphosphatidyl)inositol-3-phosphate","Oregonin","Bisphenol b","Bisphenol c","Buprenorphine glucuronide",".beta.-d-glucopyranosiduronic acid, 4-[3-(1-naphthalenylcarbonyl)-1h-indol-1-yl]butyl","Thr-Ser-Lys","1.alpha.-methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol glucuronide","8-[2-(3,4-dihydroxy-2,5-dimethoxyoxolan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1h-naphthalene-4,2'-oxirane]-2,3-diol","Ser-Gln","Oxyacanthine","1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'-myo-inositol-4',5'-bisphosphate)","Dehydroascorbic acid","Deoxythymidine 5'-phosphate (dTMP)","Guanidinopropionic acid","Givinostat","Djenkolic acid","Colchicine","Guanidinoethyl sulfonate","4-imidazolidineheptanoic acid, 3-[(2-cyclohexyl-2-hydroxyethyl)amino]-2,5-dioxo-1-(phenylmethyl)-","Isoflavone base + 1o, 2meo, o-hex+c7h12no","Asiatic acid","Adenosine 5'-phosphosulfate","2-[(3r,8as)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]pentanedioic acid","Bazedoxifene","Honokiol","Dihydrocucurbitacin f","Taurochenodeoxycholate","Vardenafil","Macluraxanthone","N.omega.-propyl-l-arginine","Asn-Gln","[(1r,3ar,5r,5ar,8ar,9ar)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1h-azuleno[6,5-b]furan-9-yl] acetate","Diclofenac","2-[5-[[4-acetyloxy-5-(2,4-dioxopyrimidin-1-yl)-3-(4-hydroxy-2-methoxy-6-methylbenzoyl)oxyoxolan-2-yl]methoxycarbonyl]-2-hydroxyphenoxy]prop-2-enoic acid","Fludioxonil","Lactobionic acid","Nabilone","Pg 42:11","His-ser","Ginsenoside rf","1-hexadecanoyl-2-sn-glycero-3-phosphate","Hederasaponin b","Ginsenoside rd","Ginsenoside re","Samidin","8,11-tridecadienoic acid, 13-(3-pentyl-2-oxiranyl)-, (8z,11z)-","D-ribose 5-phosphate","Dobutamine","Glycerophosphate(2)","Cytidine 3'-monophosphate","Biocytin","Pe 37:6","Pe(16:1e/14,15-epete)","1-o-hexadecyl-2-o-ethyl-sn-glycero-3-phosphocholine","N-Acetylglucosamine 1-phosphate","Sarcosine","Pc 44:12","5a,6-anhydrotetracycline","(2s,3s)-2-[(2s,4r,5r,6r)-4-[(4r,5s,6r)-4-[(2s,4s,5r,6r)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-3-[(1s,3s,4r)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-6-[(2s,4r,5r,6r)-4-[(2s,4r,5s,6r)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5-methoxy-6-methyloxan-2-yl]oxy-8,9-dihydroxy-7-methyl-3,4-dihydro-2h-anthracen-1-one","Glomelliferic acid","Lpc 16:0","Taurine","Gluconasturtiin","9-hydroxy-10e,12z-octadecadienoic acid","Pi 34:1","Bixin","(2s,3s)-6'-methyl-3-phenylspiro[oxirane-2,7'-quinazolino[3,2-a][1,4]benzodiazepine]-5',13'-dione","2-[5-[2-[2-[5-(2-hydroxybutyl)oxolan-2-yl]propanoyloxy]butyl]oxolan-2-yl]propanoic acid","Lithocholic acid","Benzoic acid, 4-[[(1r,2e,4e,6z,9z)-1-[(1s)-4-carboxy-1-hydroxybutyl]-2,4,6,9-pentadecatetraen-1-yl]thio]-","Adenosine 5'-diphosphoribose","Amidosulfuron","Physcion","3-hydroxy-3-methylglutaric acid","3.alpha.,7.alpha.-dihydroxy-12-oxocholanoic acid","Pc 40:9","Ethanesulfonic acid, 2-[(2,6-diethylphenyl)(methoxymethyl)amino]-2-oxo-","Pc 40:8","Pc 40:7","2-[(2s,3s,4s)-3-[(1s)-1-acetyloxyethyl]-5-methoxycarbonyl-2-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2h-pyran-4-yl]acetic acid","Proscillaridin","Myristoleic acid","1h-indazole-1-pentanoic acid, 3-[(tricyclo[3.3.1.1(3,7)]dec-1-ylamino)carbonyl]-","Sertraline carbamoyl glucuronide","Pe 36:1","Vinblastine","His-Phe","2,8-quinolinediol","[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 3,4-dihydroxybenzoate","Prednisone","Gln-gln","Ascomycin","Cetirizine","1-hexadecanoyl-sn-glycero-3-phospho-(1'-myo-inositol)","Garcinol","Hosenkoside a","Garcinolic acid","Bezafibrate","5-L-Glutamyl-L-alanine","2,8-bis(trifluoromethyl)quinolin-4-ol","Pi(18:0/20-hdohe)","Kuwanon g","Undecanoic acid","2-oleoyl-1-stearoyl-sn-glycero-3-phosphoserine","Poliumoside","Tetradecylphosphonate","Thiamphenicol","Azadirachtin","Ganoderic acid f","Irisxanthone","Cystine","Phenylacetylaspartic acid","Tyr-Trp","Echinatin","Ganoderic acid a","Cetraxate","Phe-Gly-Phe","Val-Ile","Ammelide","1,2-dioleoyl-sn-glycero-3-phosphate","Phorbol","3-dehydroepiandrosterone sulfate","Amygdalin","5-amino-2-(3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl)-5-oxopentanoic acid","Phenylalanine","1-methyluric acid","Piperonyl butoxide","17-trifluoromethylphenyl-13,14-dihydrotrinorprostaglandin f1.alpha.","Asperuloside acid","N-acetylaspartylglutamic acid","Psoralidin","Perfluoropentanoic acid","Rebaudioside b","Rebaudioside c","(2s,3s)-3,5,7-trihydroxy-6-methyl-2-(3,4,5-trihydroxyphenyl)-2,3-dihydrochromen-4-one","L-alaninamide, n-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methyl-1-oxopentyl]-3-(2-naphthalenyl)-l-alanyl-","Alanine-2,3,3,3-d4","P-fluoro-l-phenylalanine","Uracil","Domoic acid","2-docosahexaenoyl-1-stearoyl-sn-glycero-3-phosphoserine","Baccatin iii","[17-(2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl)-3-hydroxy-4,4,9,13,14-pentamethyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-16-yl] acetate","Dl-malic acid","Protogracillin","Rubranoside a","Dihydroketoprofen","Fahfa 34:2","Fahfa 34:1","Asn-Phe","Ostruthin","Mesoporphyrin ix","Protohypericin","Ofloxacin n-oxide","Sativanone","17-phenyltrinorprostaglandin a2","Arg-gly","D-saccharic acid 1,4-lactone",".alpha.-solanine","(1-(5-fluoropentyl)-1h-indazole-3-carbonyl)-l-valine","Guanidinosuccinic acid","N-(2-phosphate-1r-methylethyl)-5z,8z,11z,14z-eicosatetraenamide","7-benzyl-11,14-dimethyl-16-(2-methylpropyl)-10,13-di(propan-2-yl)-17-oxa-1,5,8,11,14-pentazabicyclo[17.3.0]docosane-2,6,9,12,15,18-hexone","Arachidonoylserinol","Ps 36:3","Brazilin","Malate","Pregnenolone sulfate","Carvedilol","Beclomethasone dipropionate","1-(5z,8z,11z,14z-eicosatetraenoyl)-sn-glycero-3-phosphocholine","Rugulosin","Adenosine 5'-diphosphate","5-aminoimidazole-4-carboxamide","2'-deoxycytidine 5'-diphosphate","Lomefloxacin","7-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-3-[4-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]chromen-4-one","Benzoylnorecgonine","2-methoxy-5-nitrophenol","5,8,11,14-eicosatetraenamide, n-(4-hydroxy-2-methylphenyl)-, (5z,8z,11z,14z)-","4',6'-dimethoxy-2'-hydroxyacetophenone","Hymeglusin","Rescinnamine","Halofenozide","Skullcapflavone ii","Calpain inhibitor i","1h-indole-1-acetic acid, 5-fluoro-2-methyl-3-(2-quinolinylmethyl)-","Met-Asn","Apigenin 7-glucuronide","(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,1 6,19-Docosahexaenoic acid","[(2r,3s,4s,5r,6s)-6-[(2s,3r,4r,5r,6s)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (e)-3-(4-hydroxyphenyl)prop-2-enoate","Met-Asp","Indinavir","His-Trp","3-(5-hydroxy-2,2,7,8-tetramethyl-6-oxo-7,8-dihydropyrano[3,2-g]chromen-10-yl)hexanoic acid","Khayanthone","Cilastatin","Codeine-6-.beta.-d-glucuronide","Catalpol","Methyl (1s,4as,7as)-4'-[(1s)-1-[(e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyethyl]-5'-oxo-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[4a,7a-dihydro-1h-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate","D-arabinose","(1s,3r,4r,5r)-3-[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid","Pi 38:6","Pi 38:7","Heptadecanoic acid","Cdp-ethanolamine","Repaglinide","Pc(16:1e/17-hdohe)","[6-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate","Cytidine 5'-diphosphocholine (CDP-choline)","Myriocin-12-en","Pi 38:5","Tyr-Leu","Timosaponin b ii","Glutamine","Pi 38:3","Acemetacin","Palmitic acid","Curculigoside","Flavin mononucleotide (fmn)","Lnt","Hastatoside","Clodinafop","2-[2,6-bis(3-methylbut-2-enyl)-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2-hydroxyacetic acid","Glycyl-l-norleucine","Ser-Phe","Demethylwedelolactone","Cefadroxil","D-aspartic acid","Pc(18:2/20-hete)","Thr-Tyr","5,6-dihydroxy-3',4'-dimethoxyflavanone","Esculin","Microcystin la","Nervonic acid","Mollicellin i","Pe 32:1","5-[[4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentanoic acid","Phenylbutazone","Rutamarin","4,4'-dihydroxy-2,2',6,6'-tetrachlorobiphenyl","L-arginine, n2-[2-(2,2-diphenylethoxy)acetyl]-","2-(p-chlorophenoxy)-2-methylpropionic acid","Pg 42:8","Gatifloxacin","Pg 42:9","Hederacoside c","Formononetin","Cer[ns] d32:1","Hesperidin","Ergothioneine","Glimepiride","Anthralin","Dl-lactate","N-allyladenosine","Amikacin","Methanone, (6-hydroxy-1-pentyl-1h-indol-3-yl)-1-naphthalenyl-","Phosphatidylethanolamine 18:1-20:4","Quinoclamine","Ginsenoside f2","Arachidonoylserotonin","1-myristoyl-2-palmitoyl-sn-glycero-3-phosphocholine","Dronedarone","Methyl (4r,8as)-1-hydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4-[(2e,4e,6e)-octa-2,4,6-trienoyl]oxy-4a,6,7,8-tetrahydro-4h-naphthalene-1-carboxylate","Microcystin lr","Nizatidine","Pc(16:0e/5,6-eet)","Cycloxydime",".alpha.,.alpha.'-trehalose 6-phosphate","Apiin","C.i. acid blue 90","Benzoyl-phe-Ala-arg","Gamma-Glu-Cys",".beta.-glycerophosphate","1-Hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoric acid","Glabrolide","Xanthine",".alpha.-cyclodextrin","9-aminocamptothecin","(2-aminoethoxy)[3-[hexadec-1-en-1-yloxy]-2-[hexadec-9-enoyloxy]propoxy]phosphinic acid","L-Glutamine","Rutaevin","9s,11,15s-trihydroxythrombox-13e-enoic acid","N-acetyl-d-mannosamine","L-gulono-1,4-lactone","2',3'-dideoxycytidine","1-(1,2r-dihexadecanoylphosphatidyl)inositol-3,4,5-trisphosphate","Lasepitin","2,3-quinoxalinedione, 1,4-dihydro-6,7-dinitro-","Methyl 4,10-diacetyloxy-5,9-dihydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate","5-sulfosalicylic acid","2'-hydroxy-3,3',4'-trimethoxychalcone","Flavone base + 3o, 1meo, c-hex-feruloylhex","Isosakuranetin","N-alpha-acetyl-l-lysine","Aldosterone","(+)-fluprostenol","Rimsulfuron","O-succinyl-l-homoserine","5-isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester","Glucotropaeolin","(1s)-1,5-anhydro-1-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]-d-glucitol","Fahfa 30:0",".gamma.-glu-cys","1-hydroxy-2-(9z,12z,15z-octadecatrienoyl)-sn-glycero-3-phosphocholine","Cis-moxifloxacin acyl-.beta.-d-glucuronide","Thamnolic acid","Lys-lys","7-Methylxanthine","(3-bromo-5-chloro-2-hydroxyphenyl)phenylmethanone","3-hydroxyoctanoic acid","Asn-Tyr","Undecanedioic acid","Anziaic acid","Trp-Cys","Equilin","Irbesartan","Ser-Leu","Indole-3-butyric acid","N-acetyl-d-glucosamine","16-hydroxy-4z,7z,10z,13z,17e,19z-docosahexaenoic acid","N-acetylcytidine","3-furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2r,3s)-","Rifapentine","Phosphatidylserine 19:0-22:6","Thr-Pro","D-ribulose 1,5-bisphosphate","Epalrestat","3r-[[(4-fluorophenyl)sulfonyl]amino]-1,2,3,4-tetrahydro-9h-carbazole-9-propanoic acid","1-hydroxy-2-(9z,12z,15z-octadecatrienoyl)-sn-glycero-2-phosphocholine","Phosphonic acid, p-[(3r)-3-amino-4-[(3-hexylphenyl)amino]-4-oxobutyl]-","2-hydroxymyristic acid","Evodiamine","Celastramycin a","Cis-9-palmitoleic acid","Desferrioxamine d2","15(r)-methylprostaglandin a2","Cephalexin","2-pyridinecarboxylic acid, 6-[2-[5-chloro-2-[(2,4-difluorophenyl)methoxy]phenyl]-1-cyclopenten-1-yl]-","Urocanate","Fluazifop","Aminomethylphosphonic acid","(2r,3s,4as,7r,8r,8as)-2,3,4'-trihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-7,8-dihydro-3h-furo[2,3-e]isoindole]-6'-one","Asn-Leu","Ser-Trp","Trp-Tyr","Prostaglandin f2.beta.","Trypan blue","Adenosine 3',5'-cyclic monophosphate","4-bromophenol","Lewis b tetrasaccharide","Eleutheroside e","Sedoheptulose 7-phosphate","9,11-methane-epoxyprostaglandin f1.alpha.","Periplocin","Geranyl diphosphate","5-[(z)-12-(3,5-dihydroxyphenyl)dodec-8-enyl]benzene-1,3-diol","Icilin","Nomilin","Propanoic acid, 2-(4-chloro-2-methylphenoxy)-","Taurolithocholic acid sulfate","Silychristin","Pi 34:2","2'-Deoxyguanosine 5'-monophosphate (dGMP)","6a,12a-didehydroamorphigenin","1,2-dioleoyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4',5'-trisphosphate)","9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one","Ser-Lys","7-chloro-3-methylquinoline-8-carboxylic acid","L-thyronine","sn-Glycerol 3-phosphoethanolamine","1-stearoyl-2-hydroxy-sn-glycero-3-phosphate","Soyasapogenol b base + o-hexa-pen","Echinacoside","Tsugaric acid a","1-lauroyl-2-hydroxy-sn-glycero-3-phosphocholine","Limonin","Quinolin-8-ol","Prostaglandin f1.alpha.","Deoxyinosine","Ciprofloxacin piperazinyl-n4-sulfate","Undecanamide, n-cyclopropyl-11-(3-hydroxy-5-pentylphenoxy)-","8-(trifluoromethyl)quinolin-4-ol",".alpha.-apooxytetracycline","Hexanoylglycine","Triflumuron","2-oxoadipic acid","5'-carboxymeloxicam","Chenodeoxycholic acid 24-acyl-.beta.-d-glucuronide","Ganoderic acid c6","Clofibric acid acyl-.beta.-d-glucuronide","Paxilline","3-oxo-4-cholestenoic acid","Octadecanedioic acid","Fa 18:1+1o","5'-iodoresiniferatoxin","20-trifluoroleukotriene b4","Desomorphine","D-galacturonic acid","Tazarotenic acid","Delta4-dafachronic acid","Diacetone-d-galacturonic acid","Adenylosuccinate","Benzeneacetic acid, 3-[3-[[[2-chloro-3-(trifluoromethyl)phenyl]methyl](2,2-diphenylethyl)amino]propoxy]-","7-hydroxyflavone","1,2,3-benzenetriol","Fulvestrant 9-sulfone","Val-Ala","1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)","Pg 34:2","N,n'-diacetylchitobiose","Pg 34:3","N-(.alpha.-linolenoyl)tyrosine","Arg-Val","1-arachidoyl-2-hydroxy-sn-glycero-3-phosphocholine","Glutaric acid","N-acetyl-l-aspartic acid","Sclareol","(-)-epigallocatechin","Cis,cis-muconic acid","11-oxatetradecanoic acid","Astilbin","7-glu tricin","3'slec","Astringin","Bisphenol tmc","Pc(16:0/13-hode)","Luminespib","Rotenone","For-Met-Ala-Ser","Tyr-His","6-phosphogluconic acid","Dimboa + o-hex-hex","Isoetharine","1-octadecanoyl-sn-glycero-3-phosphoserine","Mycophenolate mofetil","5-aminolevulinic acid","Neoandrographolide","Citrate","Kaempferol-3-glucoside-3''-rhamnoside","Quillaic acid","(1r,3ar,3bs,4ar,6s,7s,7ar,8r,8ar,9ar)-1,4a,8-tris(acetyloxy)-2,2,3b,6,8a-pentamethyl-4,9-dioxo-tetradecahydro-1h-cyclopenta[a]s-indacen-7-yl butanoate","Crotonoside","1-(5z,8z,11z,14z-eicosatetraenoyl)-sn-glycero-3-phospho-(1'-myo-inositol)","Sec-o-glucosylhamaudol","Ps 40:7","N-acetyl-l-glutamate","2,4-dichlorophenylacetic acid","Biliverdin","4-hydroxy-2',3,3',4',5,5'-hexachlorobiphenyl","Loganin","2',6'-dihydroxy 4'-methoxydihydrochalcone","Hecogenin","Forsythoside e","(1s,4as,7s,7as)-7-hydroxy-7-methyl-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyl)oxymethyl]oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1h-cyclopenta[c]pyran-4-carboxylic acid","2-hydroxyatorvastatin lactone","2-propenamide, 2-cyano-3-(3,4-dihydroxyphenyl)-n-phenyl-, (2e)-","Uridine","Imazamox","(3e,7e,11e,15e)-5,9,13,17,18-pentahydroxy-4,6,8,10-tetramethyl-2-[(e)-2-methylbut-2-enyl]nonadeca-3,7,11,15-tetraenedioic acid","L-arabinitol","Nicosulfuron-tp ucsn","Nilotinib","Met-Lys","Phe-met-arg-phe-amide","Icaritin","1-palmitoyl-2-oleoyl-phosphatidylglycerol","(2s)-2-[(3r,7r,8r,8as)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]pentanedioic acid","Chlorambucil","Ononin","Pe(18:0/9-hode)","Cis-aconitate","Bafilomycin b1","2-[[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-hydroxy-6-methylbenzoyl]amino]-3-hydroxybutanoic acid","Losartan","Donepezil","Lpe 18:2","Thr-Ala","Aspartic acid","Liquiritin","Benzeneacetic acid, 4-chloro-.alpha.-(4-chlorophenyl)-","Pi(18:0/9-hode)","N-acetyl-s-farnesyl-l-cysteine","N.alpha.-benzoyl-asn-gly-thr-amide","Dolasetron","Catalposide","17,20,21-trihydroxypregn-1-ene-3,11-dione","Cochlioquinone a","Zafirlukast","Alpha-ketoglutarate","Progoitrin","(2r)-2-[(2r,5s)-5-[(2s)-2-hydroxybutyl]oxolan-2-yl]propanoic acid","Rutarin","3,4-dihydroxymandelic acid","Udp-xylose","8-iso-16-cyclohexyltetranorprostaglandin e2","Glucoiberin","3,4-dihydroxy-l-phenylalanine","Urapidil","Bisphenol af","Propentofylline","N-acetyl-l-methionine","5,7,3',4',5'-pentahydroxyflavone","Methyl 2-(4a,6,10a-trihydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1h-benzo[g]isochromen-3-yl)acetate","Bungeiside c","3-hydroxy-2',4',6'-trichlorobiphenyl","2-amino-3-[[(6e,9e)-5-hydroxy-8-methoxy-5,9,13,14-tetramethyl-2-oxo-1-oxacyclotetradeca-6,9-dien-4-yl]sulfanyl]propanoic acid","15(r),19(r)-hydroxyprostaglandin f1.alpha.","Chelidonin","Artesunate","1h-indole-3-carboxylic acid, 1-(cyclohexylmethyl)-",".beta.-zearalenol","2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]-ethanesulfonic acid","Atalaphylline","Benzoic acid, 4-[[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)carbonyl]amino]-","Taurocholic acid","9-hydroxy-5b,8,11a-trimethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a,8-tricarboxylic acid","11-dehydrothromboxane b3","11-dehydrothromboxane b2","Corymbosin","Arctiin","Rauwolscine","Nephrosteranic acid","Lacidipine","3-o-acetyl-16alpha-hydroxytrametenolic acid","Pregna-4,16-diene-3,20-dione","Glu-Gly-Glu","2,3-dinor-8-isoprostaglandin-f2.alpha.","Pentaerythritol tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)","2-naphthalenecarboxamide, 1-hydroxy-n-[2-(5-hydroxy-1h-indol-3-yl)ethyl]-","1,3-benzenediol, 4-chloro-6-[5-[[2-(4-morpholinyl)ethyl]amino]-1,2-benzisoxazol-3-yl]-","1h-indole-1-pentanoic acid, 3-[(8-quinolinyloxy)carbonyl]-","2',2'-difluoro-2'-deoxyuridine","Neburon","Repaglinide acyl-.beta.-d-glucuronide","Pc 33:0","Sweroside","Ser-His","Asp-Met","Gibberellin a9","Senegenin","1-(1,2-dioctanoylphosphatidyl)inositol-3,5-bisphosphate","Gibberellin a4","Pc(16:0e/13-hode)","Leprapinic acid","Zearalenone","L-rhamnose","[(6e,10z)-10-(acetyloxymethyl)-6-formyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylbutanoate","Pe 44:10","Germbudine","1h-indole-6-carboxamide, n-hydroxy-1-[(4-methoxyphenyl)methyl]-","Oxacillin","Pi(18:0/8,9-eet)","D-psicose","2-[[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]oxane-3,4,5-triol","Acetic acid, 2-[[2'-(5-ethyl-3,4-diphenyl-1h-pyrazol-1-yl)[1,1'-biphenyl]-3-yl]oxy]-","Pg 38:7","Protoveratrine a","Lichesterinic acid","(2s,3r,4s,5s,6r)-2-[4-[(3r,4s)-4-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol","Coniferin","[2.3-dihydroxypropoxy][2-[docosa-4.7.10.13.16.19-hexaenoyloxy]-3-[octadec-9-enoyloxy]propoxy]phosphinic acid","Acamprosate","(2r,3s,4s,5r,6r)-2-[[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-(2-phenylethoxy)oxane-3,4,5-triol","Phosphatidylcholine alkenyl 16:0-16:0","Pentanoic acid, 5-[(3ar,4r,5r,6as)-3,3-difluorohexahydro-5-hydroxy-4-[(1e,3s,4s)-3-hydroxy-4-methyl-1-nonen-6-ynyl]-2h-cyclopenta[b]furan-2-ylidene]-, (5z)-","1-aminocyclopropanecarboxylic acid","N-.alpha.-acetyl-l-ornithine","Cycloxydim-tp bh 517-tso e/z-isomer","3-(n-morpholino)-2-hydroxypropanesulfonic acid","Roseoflavin","Rifabutin","D-turanose","Val-Asn","Quercetin 3-glucoside","1-deoxy-1-(methylamino)-d-galactitol","Swertisin","6''-o-acetylglycitin","Benzoic acid, 4-[[tetrahydro-2-(3-hydroxy-1-butenyl)-5-oxo-3-furanyl]amino]-","Tapentadol-.beta.-d-glucuronide","D-2-phosphoglyceric acid",".beta.-tocotrienol","Heptanedioic acid, 1-[2-[(2-carboxyphenyl)methylene]hydrazide]","Theobromine","Orotate","Val-Arg","Tenofovir","Tubeimoside a","N-oleoyl-phenylalanine","Oseltamivir acid","Tropisetron","4,4'-methylenediphenol","Jasmonic acid","Hesperetin","Asn-Lys","4'-hydroxydiclofenac","N-arachidonoyl-.gamma.-aminobutyric acid","1-(((2-aminoethoxy)(hydroxy)phosphoryl)oxy)-3-(hexadecyloxy)propan-2-yl-icosa-5.8.11.14-tetraenoate","5-hydroxy-l-tryptophan","Ginsenoside rg5","1h-indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-5-fluoro-.alpha.,.alpha.,3-trimethyl-","17-trifluoromethylphenyltrinorprostaglandin f2.alpha.","Borrelidin","Geniposide","Glu-Asn","Polyphyllin vi","Leu-Leu-Tyr","Atorvastatin","3,4,5-trimethoxycinnamic acid","O-desmethylastemizole","Letrozole","N-acetylneuraminic acid","Phosphatidylcholine lyso 14:0","4'-methoxyflavone","4-hydroxy-3-[(e)-7-hydroxy-3,7-dimethyl-4-oxooct-5-enyl]-5-(3-methylbut-2-enyl)benzoic acid","Dimethylbenzimidazole","Methanone, (5-hydroxy-1-pentyl-1h-indol-3-yl)-1-naphthalenyl-","2-((octadec-9-enoyl-16,16,17,17,18,18,18-d7)oxy)-3-(pentadecanoyloxy)propyl (2,3,4,5,6-pentahydroxycyclohexyl) phosphate","1,2-dioleoyl-sn-glycero-3-phosphoethanolamine-n-methyl","Pc(16:1/9-hode)","Trp-Ser","11,14,17-eicosatrienoic acid, (z,z,z)-","(1r,4s,7r,8s)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2s)-3-hydroxy-2,4-dimethyl-5-oxo-2,5-dihydrofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione","[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(3-hydroxy-5-oxooxolan-3-yl)propoxy]oxan-2-yl]methyl (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate","Metolachlor oa","8-methyl-2-(trifluoromethyl)quinolin-4-ol","11,12-dihydroxy-13-methoxy-4,5,8-trimethyl-3-(2-methylpropyl)-1h,2h,3h,4h,6ah,9h,10h,11h,12h,13h,14h,15h,15bh-cycloundeca[e]isoindole-1,15-dione","L-pyroglutamic acid","Marbofloxacin","Indoprofen","Cornuside","Resorcinol sulfoxide","Kendomycin","Vincristine","13(S)-HODE","2-heptyl-4-hydroxyquinoline n-oxide","Benzenepropanoic acid, 5-(3-carboxybenzoyl)-2-[[(5e)-6-(4-methoxyphenyl)-5-hexen-1-yl]oxy]-","2,5-dichlorobenzene-1,4-diol","1-methylene-5.alpha.-androstan-3.alpha.-ol-17-one glucuronide","Pentachlorophenol","Progesterone","Val-Gly-Val","Boldine","Gitoxigenin diacetate","Chalepensin","N-(phenylacetyl)-l-phenylalanine","Naringenin","Xanthohumol","Embelin","Pe(16:1e/10-hdohe)","62fta","11beta-hydroxyprogesterone","2-isopropylmalic acid","2-(2-hydroxypropan-2-yl)-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrofuro[3,2-g]chromen-7-one","4',6'-dimethoxy-2'-hydroxy-3-nitrochalcone","[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 3-acetyloxy-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanoate","Piperacillin","1,2-dioleoyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4'-bisphosphate)","Morroniside","3,4-dihydroxycinnamic acid (l-alanine methyl ester) amide","Gly-Arg",".beta.-estradiol 3-sulfate","Asn-Met","3-[(2s,3r,4s,5r,6r)-3-[(2s,3r,4r,5s,6s)-3,5-dihydroxy-6-methyl-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-[[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one","Bergenin","Phe-trp","Lisinopril","Thiamine monophosphate","Picrotin","Succinate","5'-deoxyadenosine","Ng,ng-dimethyl-l-arginine","Muramic acid","Leukotriene f4","Volemitol","Malformin a2","(2-aminoethoxy)[3-[hexadec-1-en-1-yloxy]-2-[icosa-5.8.11.14-tetraenoyloxy]propoxy]phosphinic acid","Porphobilinogen","Maresin 1","N-oleoyl-l-serine","5(s),14(r)-lipoxin b4","Astragaloside i","Ile-Tyr","Methanone, [1-(5-hydroxypentyl)-1h-indol-3-yl](4-hydroxyphenyl)-","Oleuropein","Pe(16:0e/12-hete)","N,n'-bis(sinapoyl)spermidine","Sinapoyl malate","Chlortetracycline","Met-Met","Selaginpulvilin o","Pentoxazone","Selaginpulvilin n","Substance p (9-11)","Confluentic acid","Lactulose","Ricinoleic acid","Clavulanic acid","Celastrol","(-)-epicatechin","(19r)-9-acetyl-19-hydroxy-10,14-dimethyl-20-oxopentacyclo[11.8.0.0<2,10>.0<4,9 >.0<14,19>]henicos-17-yl acetate","Rhapontigenin","Benthiavalicarb-isopropyl","Citrinin","Leukotriene e4","L-fucose","Ile-Pro","Flurtamone","Alpha-solanine","2(1h)-pyridinone, 3-[(2s,4s,5r)-5,6-dichloro-2,4-dimethyl-1-oxohexyl]-4-hydroxy-5,6-dimethoxy-","2-(5-acetyl-2,3-dihydro-1-benzofuran-2-yl)prop-2-enyl 3-methylbutanoate","Garcinone c","Hexose + c13h17o3","6-quinoxalinecarbonitrile, 1,2,3,4-tetrahydro-7-nitro-2,3-dioxo-","Sotalol","2,4-dichlorobenzoic acid","Pe 35:2","Bucharaine","N-arachidonoyl-3-hydroxy-.gamma.-aminobutyric acid","Nordihydroguaiaretic acid","Galactinol","Penciclovir","Leukotriene d4","Osthole","Securinine","(e)-5-[(1s,4ar,8ar)-2-formyl-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-(acetyloxymethyl)pent-2-enoic acid","Zeranol","Aloin","Estrone glucuronide","1,2-dioleoyl-sn-glycero-3-phospho-(1'-myo-inositol-4',5'-bisphosphate)","Acid orange 7 (free acid)","5,7-dihydroxy-3',4',5'-trimethoxyflavanone","Cholic acid, methyl ester","N-acetyl-l-carnosine","Propanedinitrile, 2-[(3-hydroxy-4-nitrophenyl)methylene]-","Isoorientin","Kasugamycin","(2-aminoethoxy)[2-[docosa-4.7.10.13.16.19-hexaenoyloxy]-3-[octadeca-1.9-dien-1-yloxy]propoxy]phosphinic acid","Plumieride","Formylciprofloxacin","1-o-(9z-octadecenyl)-sn-glycero-2,3-cyclic-phosphate","Pe 22:0","2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizine","(2e,6e,12e)-18-(2,6-dioxopiperidin-4-yl)-9,11-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,12-trienoic acid","Gln-lys","Cannabidiolic acid","alpha-D-Glucose 1-phosphate","Gossypol","Aleuritic acid","N-stearoyltaurine","11(12)-epoxy-5z,8z,14z,17z- eicosatetraenoic acid","Formoterol","Indoleacrylic acid","Valerenic acid","6-acetylmorphine","Phosphatidylcholine 16","4-hydroxyvalproic acid","2-[(4s,5s,5as,9as)-4-methoxy-6,6,9a-trimethyl-5-[(2e,4e,6e)-octa-2,4,6-trienoyl]oxy-1-oxo-4,5,5a,7,8,9-hexahydro-3h-benzo[e]isoindol-2-yl]pentanedioic acid","Purpurin","Rhaponticin","Stauprimide","Fustin","L-Malic acid","13,15-dihydroxy-9-methoxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione","Sepiapterin","His-Met","[(2r,3s,4s,5r,6s)-6-[(2s,3r,4s,5r,6r)-6-[[(1s,3r,4s,4ar,8ar)-4-[(3s)-3-[(2s,3r,4r,5r,6r)-3,4-dihydroxy-6-methyl-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3-methylpent-4-enyl]-3,4,8,8a-tetramethyl-1,2,3,4a,5,6-hexahydronaphthalen-1-yl]oxy]-4,5-dihydroxy-2-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate","Thielavin b","m-Chlorohippuric acid","Alpha-alectoronic acid","11-ketofusidic acid","Humulene (alpha)","3,6-dibenzyl-9-[(2,3-diamino-1,2-dihydroindol-3-yl)methyl]-1,4,7-triazonane-2,5,8-trione","1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine","Platencin","Phosphatidylcholine lyso 18:0","Phosphatidylcholine lyso 18:2","Uridine 5'-monophosphate (UMP)","Pristimerin","(S)-2-Hydroxyglutarate","Erioglaucine","Pe 44:9","Deoxynivalenol 3-glucuronide","5.alpha.-pregnan-3.alpha.,17-diol-20-one 3-sulfate","5-fluorouridine","1h-indole-3,5-dicarboxylic acid, 1-[3-[4-(decyloxy)phenoxy]-2-oxopropyl]-, 3-methyl ester","Shikonin","[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]oxan-3-yl] 4-hydroxybenzoate","N6,N6,N6-Trimethyl-L-lysine","1-oleoyl-2-hydroxy-sn-glycero-3-phospho-(1'-rac-glycerol)","(2z)-2-[(e)-6-(hydroxymethyl)-2,4,8,10-tetramethyldodec-2-enylidene]-4-methylpentanedioic acid","1,2-dihexadecanoyl-sn-glycero-3-phosphocholine","N-.alpha.-(tert-butoxycarbonyl)-l-lysine","Nicotinate d-ribonucleotide","Dabinol","1,2-dilauroyl-sn-glycero-3-phosphate","5-heptenoic acid, 7-[(1r,2r,3s,5s)-2-[(1e,3r)-3-(2,3-dihydro-1h-inden-2-yl)-3-hydroxy-1-propen-1-yl]-3-fluoro-5-hydroxycyclopentyl]-, (5z)-","Eplerenone hydroxy acid","Shanzhiside","Sm d33:1","[3,4-dihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-3-yl]oxy-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate","Alanap","Glu-Val-Phe","16,16-dimethyl-6-ketoprostaglandin e1","1-Stearoyl-sn-glycerol 3-phosphocholine(LPC(18:0))","Hydroxycerivastatin","Arg-Lys","4'-methoxychalcone","2,4-dichlorophenol","Ethyl syringate","4-methylpentyl glucosinolate","Enalaprilat","Methyl (2e,8e)-9-[3a-hydroxy-6,7-dimethyl-1-(2-methylpropyl)-3-oxo-2,4,7,7a-tetrahydro-1h-isoindol-4-yl]-4,5-dihydroxy-8-methylnona-2,8-dienoate","Inosine","L-Serine","15(r)-17-phenyltrinorprostaglandin f2.alpha.","Naringenin-7-o-glucoside","DL-tyrosine","Lumichrome","Phenytoin","Trans-epoxysuccinyl-l-leucylamido(4-guanidino)butane","7-hydroxyflavanone","N-desmethyldroloxifene","Madecassoside","Bufexamac","Resolvin d2",".beta.-nicotinamide adenine dinucleotide, reduced(NADH)","13,14-dihydro-16,16-difluoroprostaglandin d2","Lamiide","1,7-dideacetoxy-1,7-dioxo-3-deacetylkhivorin","Soyasaponin i","Neohesperidin","Rac-5-carboxy-desisopropyltolterodine methyl ester","Ile-Phe","Cellobiose","Lufenuron","Fialuridine","Lys-Glu","6'-sialyllactose","6-phospho-d-gluconate","Arg-Met","3-Methylhistidine","5,7-dihydroxy-3',4'-dimethoxyflavanone","D-gluconate","Eseroline fumarate","13,14-dihydro-16,16-difluoroprostaglandin e1","18-hydroxy-5z,8z,11z,14z,16e-eicosapentaenoic acid","N-(4-aminobenzoyl)-l-glutamic acid","Dihydrotanshinone i","Pg 30:0","Spirostane + 2o, -2h, o-hex-dhex-dhex","Sebacic acid","2-chloro-1,3,8-trihydroxy-6-(hydroxymethyl)anthracene-9,10-dione","11,12,13-trihydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-1h,2h,3h,4h,6ah,9h,10h,11h,12h,13h,14h,15h,15bh-cycloundeca[e]isoindole-1,15-dione","Fipronil desulfinyl","Scandoside","Capecitabine","L-Threonate","Thymopoietin ii (32-34)","Montelukast acyl-.beta.-d-glucuronide","Arg-Gly-Asp","9-nitro-20(s)-camptothecin","Anacardic acid","1-myristoyl-sn-glycero-3-phosphocholine","Mycophenolic acid .beta.-d-glucuronide","16-phenyltetranorprostaglandin e1","7-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid","16-phenyltetranorprostaglandin e2","Prephenate","Glucose 1-phosphate","Pi(16:1/13-hode)","Udp-galactose","2-(2h-benzotriazol-2-yl)-4,6-bis(1-methyl-1-phenylethyl)phenol",".beta.-d-glucopyranuronic acid, 1-[3-(1-naphthalenylcarbonyl)-1h-indole-1-pentanoate]","Asp-Ile","Icarin","Dodecanedioic acid","10-undecynoic acid","Pc(16:1e/19,20-epdpe)","5s-hydroxy-6e,8z,11z,14z-eicosatetraenoic acid","17.alpha.-dihydroequilin 3-sulfate","Variolaric acid","Imperatorin","[4,8-dihydroxy-3-(3-methoxy-3-oxoprop-1-en-2-yl)-8a-methyl-5-oxo-1,2,3,4,4a,6,7,8-octahydronaphthalen-2-yl] 3,4-dihydroxy-2-methylidenebutanoate","1-[[(2s,3r,11br)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2h-isoquinolin-6-one","Sildenafil","Pi(16:0/9-hode)","Leu-Glu","Ezetimibe","Labetalol","Ganoderic acid c 2","Flubendazole","1-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-6-hydroxy-7-methylidene-4a,5,6,7a-tetrahydro-1h-cyclopenta[c]pyran-4-carboxylic acid","Pantetheine","[(6z,10z)-6-(acetyloxymethyl)-10-(hydroperoxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylbutanoate","2-(3,4-dihydroxyphenyl)ethyl (4s,5z,6s)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-(2-hydroxyethylidene)-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4h-pyran-3-carboxylate","10-deacetylbaccatin iii","Lactitol","Leukotriene b5","5-(diethoxyphosphoryl)-5-methyl-1-pyrroline-n-oxide-biotin","Profoxydim","[(2s,3r)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2h-chromen-7-yl] 3,4,5-trihydroxybenzoate","Picroside i","3.beta.-hydroxymevastatin","Gardenoside","(-)-catechin gallate","N-.alpha.-(tert-butoxycarbonyl)-l-leucine","Phosphatidylinositol 16","Valganciclovir","Myricetin-3-o-xyloside","Maltose","5-methoxytryptophan","2-chloro-2'-hydroxy-4'-methylbenzophenone","Quercetagetin","Digalacturonic acid","Adenosine, cyclic 3',5'-[hydrogen [p(s)]-phosphorothioate]","Hypocrellin a","Pe 40:9","Mitragynine","Pterine","Pe 40:4","Puerarin","D-Glucuronolactone","Pc(17:0/12-hete)","Raffinose","Goniothalenol","Chebulagic acid","2-pentanone, 5-[3-(4-hydroxybenzoyl)-1h-indol-1-yl]-","Carboxyphosphamide","(3-phenylpropionyl)glycine","Taccalonolide a","[1-[[2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-[octadec-11-enoyl]oxypropan-2-yl] octadecanoate","Phe-phe","N,n'-dicarbobenzyloxy-l-ornithine","Loganic acid","Fenoxaprop-p","Salicyluric acid","Benzophenone-2","2'-deoxyadenosine 5'-diphosphate","1,2-di-(9z-tetradecenoyl)-sn-glycero-3-phosphocholine","Tolterodine","Gardnerine","Phosphocreatine","9-nitrooleic acid","Deacetoxy(7)-7-oxokhivorinic acid","Fahfa 40:1","Galacturonate 1-phosphate","Anisomycin","Deoxycytidine","Ser-Met","6-(trifluoromethyl)quinolin-4-ol","1h-indole-1-pentanoic acid, 3-[2-(2-chlorophenyl)acetyl]-","N-oleyl-leucine","Lucidin","Benzoin","Asiaticoside"],"pubmed_abstract":["Temperature is a critical environmental factor that influences the growth, development, metabolism, and overall physiological performance of fish. Eleutheronema tetradactylum is an economically significant fish species; however, its molecular mechanism's response to long-term cold stress is still unclear. In this study, we investigated the physiological responses of the liver in E. tetradactylum exposed to a constant temperature of 18 °C for durations of both 7 and 14 days, utilizing liquid chromatography-mass spectrometry (LC-MS), metabolomics, and conventional biochemical assays. The antioxidant status, liver histology, and metabolite profiles were examined at different time points. Our results revealed that, following sustained cold exposure, the activities of key antioxidant enzymes-superoxide dismutase (SOD), catalase (CAT), and glutathione peroxidase (GPx)-initially increased and then decreased. Additionally, levels of malondialdehyde (MDA), a marker of oxidative damage, significantly elevated after 7 and 14 days of cold stress. Histopathological examination of liver tissues showed varying degrees of vacuolation and nuclear atrophy in hepatocytes, indicating oxidative damage. Metabolomic profiling identified 87 and 116 differentially expressed metabolites in the liver on days 7 and 14, respectively. Pathway enrichment analysis revealed significant alterations in pathways related to carbohydrate digestion and absorption, glutathione metabolism, and glycerolipid metabolism. These findings suggest that mechanisms regulating cell membrane fluidity, energy metabolism, autophagy, and antioxidant defense are crucial for the adaptation of E. tetradactylum to cold stress. Overall, this study provides valuable insights into the molecular and physiological adaptations of E. tetradactylum to low temperature, highlighting the activation of protective antioxidant responses and modifications of metabolic pathways in the liver."],"pubmed_title":["Metabolomics-Based Analysis of Adaptive Mechanism of <i>Eleutheronema tetradactylum</i> to Low-Temperature Stress."],"pubmed_authors":["Jin Minxuan M, Zheng Anna A, Mkulo Evodia Moses EM, Wang Linjuan L, Zhang Huijuan H, Tang Baogui B, Zhou Hui H, Wang Bei B, Huang Jiansheng J, Wang Zhongliang Z"],"additional_accession":[]},"is_claimable":false,"name":"Metabolomics-Based Analysis of Adaptive Mechanism of Eleutheronema tetradactylum to Low-Temperature Stress","description":"Temperature is a critical environmental factor influencing fish physiology. Eleutheronema tetradactylum is an economically important warm-water species, but its response to long-term cold stress remains unclear. In this study, we exposed juvenile fish to 18 °C for 7 and 14 days and investigated hepatic adaptations using LC-MS-based untargeted metabolomics, combined with histological examination and antioxidant enzyme assays. We observed that cold stress initially elevated the activities of superoxide dismutase, catalase, and glutathione peroxidase at day 7, but these declined by day 14, while malondialdehyde levels progressively increased, indicating accumulated oxidative damage. Histological analysis revealed vacuolation and nuclear atrophy in hepatocytes, especially after 14 days. Metabolomic profiling identified 87 and 116 differentially expressed metabolites at day 7 and day 14, respectively. Pathway enrichment showed early activation of carbohydrate digestion and absorption, starch and sucrose metabolism, and glutathione metabolism, suggesting enhanced energy mobilization and antioxidant defense. At day 14, significant alterations emerged in glycerophospholipid metabolism and phosphatidylinositol signaling, reflecting adjustments in membrane fluidity and lipid homeostasis. Our findings demonstrate that E. tetradactylum copes with cold stress by upregulating energy metabolism and antioxidant systems in the short term, but prolonged exposure overwhelms these compensatory mechanisms, leading to liver damage. This study provides comprehensive metabolic and physiological insights that can inform aquaculture management under fluctuating thermal conditions.
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