{"text_format":"3","workbook":"xls","n_sheets":1,"sheets":["Table S20"],"read":"whole","date_system":"1900","formulas":"cached_only"}

{"sheet":"Table S20","index":0,"n_rows":367,"n_cols":10,"rows_kept":367,"merged":[[0,0,0,9]],"flags":["formulas_cached_only"]}
["Table S20. Metabolites with significant changes in all regions from -1.5 DPA to 5 DPA"]
["ID","m/z","Metabolites","HMDB","Formula","Super Class","Class","Sub Class","KEGG","Adduct"]
[106,133.013266261508,"D-Malic acid","HMDB0031518","C4H6O5","Organic acids and derivatives","Hydroxy acids and derivatives","Beta hydroxy acids and derivatives","C00497","-H"]
[298,189.003470119652,"Oxalosuccinic acid","HMDB0003974","C6H6O7","Organic acids and derivatives","Carboxylic acids and derivatives","Tricarboxylic acids and derivatives","C05379","-H"]
[299,189.039943693671,"3-Dehydroquinic acid","HMDB0012710","C7H10O6","Organic acids and derivatives","Hydroxy acids and derivatives","Alpha hydroxy acids and derivatives","C00944","-H"]
[450,226.996073769536,"(1R,2R)-Isocitric acid","HMDB0033717","C6H8O7","Organic acids and derivatives","Carboxylic acids and derivatives","Tricarboxylic acids and derivatives","C04617","+Cl"]
[1017,387.165953448109,"beta-D-Glucopyranosyl-11-hydroxyjasmonic acid","HMDB0039964","C18H28O9","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"-H"]
[1015,387.048699808989,"Decarbamoylgonyautoxin III","HMDB0040137","C9H16N6O7S","Phenylpropanoids and polyketides","Saxitoxins, gonyautoxins, and derivatives",null,null,"+Cl"]
[451,227.065665509348,"Deoxyuridine","HMDB0000012","C9H12N2O5","Nucleosides, nucleotides, and analogues","Pyrimidine nucleosides","Pyrimidine 2'-deoxyribonucleosides","C00526","-H"]
[396,214.048153572317,"beta-D-Glucosamine","HMDB0030091","C6H13NO5","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08349","+Cl"]
[120,135.044219500954,"Phenylacetic acid","HMDB0000209","C8H8O2","Benzenoids","Benzene and substituted derivatives",null,"C07086","-H"]
[1147,439.086559002754,"3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside)","HMDB0039307","C19H20O12","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[147,145.049746583843,"Adipic acid","HMDB0000448","C6H10O4","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C06104","-H"]
[148,145.060986438526,"Ureidoisobutyric acid","HMDB0002031","C5H10N2O3","Organic acids and derivatives","Organic carbonic acids and derivatives","Ureas","C05100","-H"]
[893,341.108902328057,"Galabiose","HMDB0029902","C12H22O11","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C00760  ","-H"]
[1212,475.164730828181,"Diferuloylputrescine","HMDB0033468","C24H28N2O6","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Cl"]
[995,377.085640244389,"Inulobiose","HMDB0029898","C12H22O11","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C03323","+Cl"]
[369,208.98530418899,"Dehydroascorbic acid","HMDB0001264","C6H6O6","Organoheterocyclic compounds","Lactones","Gamma butyrolactones","C05422","+Cl"]
[1014,387.026355790297,"13alpha-Hydroxydolineone","HMDB0030756","C19H12O7","Phenylpropanoids and polyketides","Isoflavonoids","Rotenoids",null,"+Cl"]
[146,145.013342467919,"Oxoglutaric acid","HMDB0000208","C5H6O5","Organic acids and derivatives","Keto acids and derivatives","Gamma-keto acids and derivatives","C00026","-H"]
[373,209.045051395505,"5-Hydroxyferulic acid","HMDB0035484","C10H10O5","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives","C05619","-H"]
[246,171.138367310711,"Isooctyl acetate","HMDB0032070","C10H20O2","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acid derivatives",null,"-H"]
[66,117.01824804578,"Succinic acid","HMDB0000254","C4H6O4","Organic acids and derivatives","Carboxylic acids and derivatives","Dicarboxylic acids and derivatives","C00042","-H"]
[372,209.029804407012,"Galactaric acid","HMDB0000639","C6H10O8","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C00879","-H"]
[778,314.080635828642,"Niazirin","HMDB0032807","C14H17NO5","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Cl"]
[97,131.034028954856,"(S)-2-Acetolactate","HMDB0006855","C5H8O4","Organic acids and derivatives","Keto acids and derivatives","Short-chain keto acids and derivatives","C06010","-H"]
[224,165.018517704207,"Phthalic acid","HMDB0002107","C8H6O4","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives","C01606","-H"]
[999,379.10367455295,"Lactitol","HMDB0040937","C12H24O11","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"+Cl"]
[167,149.023553875456,"4-Hydroxyphthalide","HMDB0032598","C8H6O3","Organoheterocyclic compounds","Isocoumarans","Isobenzofuranones",null,"-H"]
[594,269.087826972284,"D-erythro-L-galacto-Nonulose","HMDB0029955","C9H18O9","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[262,179.034088297474,"3,5-Dihydroxycinnamic acid","HMDB0032131","C9H8O4","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"-H"]
[386,212.04573354581,"O-Ureidohomoserine","HMDB0012271","C5H11N3O4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+Cl"]
[567,259.022402707808,"Urolithin D","HMDB0029219","C13H8O6","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins",null,"-H"]
[432,224.048992577582,"Indole-3-propionic acid","HMDB0002302","C11H11NO2","Organoheterocyclic compounds","Indoles and derivatives","Indolyl carboxylic acids and derivatives",null,"+Cl"]
[320,196.053904610913,"Tryptophol","HMDB0003447","C10H11NO","Organoheterocyclic compounds","Indoles and derivatives","Indoles","C00955","+Cl"]
[853,329.233305723577,"9,10,13-TriHOME","HMDB0004710","C18H34O5","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C14835","-H"]
[181,154.061382281234,"L-Histidine","HMDB0000177","C6H9N3O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00135","-H"]
[130,140.010867170105,"O-Phosphoethanolamine","HMDB0000224","C2H8NO4P","Organic acids and derivatives","Organic phosphoric acids and derivatives","Phosphate esters","C00346","-H"]
[568,259.061078761684,"Orientalone","HMDB0039616","C14H12O5","Benzenoids","Naphthalenes","Naphthoquinones",null,"-H"]
[132,140.994924179455,"Glyceric acid","HMDB0000139","C3H6O4","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C00258","+Cl"]
[728,305.066626486455,"(+)-Gallocatechin","HMDB0038365","C15H14O7","Phenylpropanoids and polyketides","Flavonoids","Flavans","C12127","-H"]
[399,215.032351288572,"Theophylline","HMDB0001889","C7H8N4O2","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C07130","+Cl"]
[790,317.022830476073,"Pseudobaptigenin","HMDB0036616","C16H10O5","Phenylpropanoids and polyketides","Isoflavonoids","Isoflav-2-enes","C10522","+Cl"]
[166,149.008278735626,"D-Tartaric acid","HMDB0029878","C4H6O6","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C02107","-H"]
[788,316.118984484217,"Piplartine","HMDB0030341","C17H19NO5","Phenylpropanoids and polyketides","Cinnamic acids and derivatives",null,"C10166","-H"]
[146,118.086429906125,"Ethyl acrylate","HMDB0033978","C5H8O2","Organic acids and derivatives","Carboxylic acids and derivatives","Acrylic acids and derivatives","C19238","+NH4"]
[1159,235.130416504168,"Dihydrojasmonic acid","HMDB0033601","C12H20O3","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"+Na"]
[2090,358.135027625672,"3'-Ketolactose","HMDB0001030","C12H20O11","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C05403","+NH4"]
[2091,358.20063360733,"5-hydroxypropafenone","HMDB0060988","C21H27NO4","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Cinnamylphenols",null,"+H"]
[1489,273.12068874103,"4-Coumaroyl-2-hydroxyputrescine","HMDB0033462","C13H18N2O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Na"]
[1488,273.109642316706,"Isovestitol","HMDB0030526","C16H16O4","Phenylpropanoids and polyketides","Isoflavonoids","O-methylated isoflavonoids",null,"+H"]
[1041,221.130104691534,"7-Isopropyl-1,4-dimethylazulene","HMDB0036648","C15H18","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C09675","+Na"]
[2089,358.113647060068,"Cichoriin","HMDB0030821","C15H16O9","Phenylpropanoids and polyketides","Coumarins and derivatives","Coumarin glycosides",null,"+NH4"]
[256,140.068076168737,"L-Valine","HMDB0000883","C5H11NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00183","+Na"]
[1541,279.158737868264,"Dibutyl phthalate","HMDB0033244","C16H22O4","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives","C14214","+H"]
[1158,235.109160571077,"11,12-Dihydrolactaroviolin","HMDB0035736","C15H16O","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+Na"]
[2213,381.108479728993,"Austrobailignan 7","HMDB0030859","C20H22O5","Lignans, neolignans and related compounds","Furanoid lignans","Tetrahydrofuran lignans",null,"+K"]
[257,140.106838888791,"4-Ethylphenol","HMDB0029306","C8H10O","Benzenoids","Phenols","1-hydroxy-2-unsubstituted benzenoids","C13637","+NH4"]
[2211,380.278706497798,"Annosquamosin A","HMDB0031137","C22H34O4","Lipids and lipid-like molecules","Prenol lipids","Diterpenoids",null,"+NH4"]
[1020,219.077822913601,"Cis-stilbene oxide","HMDB0059631","C14H12O","Phenylpropanoids and polyketides","Stilbenes",null,"C16014","+Na"]
[1357,257.079503747012,"Artemidiol","HMDB0030648","C13H14O4","Phenylpropanoids and polyketides","Isocoumarins and derivatives",null,null,"+Na"]
[1549,280.096399987837,"Avenalumin II","HMDB0038955","C17H13NO3","Organoheterocyclic compounds","Benzoxazines",null,null,"+H"]
[1358,257.114577651606,"(10S,11S)-Pterosin C","HMDB0030763","C14H18O3","Benzenoids","Indanes","Indanones",null,"+Na"]
[595,177.102104500653,"Serotonin","HMDB0000259","C10H12N2O","Organoheterocyclic compounds","Indoles and derivatives","Tryptamines and derivatives","C00780","+H"]
[419,160.075491047459,"Indoleacetaldehyde","HMDB0001190","C10H9NO","Organoheterocyclic compounds","Indoles and derivatives","Indoles","C00637","+H"]
[1208,241.11946204321,"(R)-Pterosin B","HMDB0030759","C14H18O2","Benzenoids","Indanes","Indanones",null,"+Na"]
[1204,241.047004407811,"4-Methylumbelliferyl acetate","HMDB0032989","C12H10O4","Phenylpropanoids and polyketides","Coumarins and derivatives",null,"C03837","+Na"]
[387,157.075522362893,"3-Indoleacetonitrile","HMDB0006524","C10H8N2","Organoheterocyclic compounds","Indoles and derivatives","Indoles","C02938","+H"]
[1356,257.060596143816,"S-[1-[2-(Acetyloxy)ethyl]butyl] ethanethioate","HMDB0037764","C10H18O3S","Organic acids and derivatives","Thiocarboxylic acids and derivatives","Thioesters",null,"+K"]
[2088,357.239644646987,"1-(3,5-Dihydroxyphenyl)-2-pentadecanone","HMDB0035283","C21H34O3","Benzenoids","Phenols","Benzenediols",null,"+Na"]
[594,177.088608188745,"L-2-Amino-4-methylenepentanedioic acid","HMDB0029433","C6H9NO4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00651","+NH4"]
[2095,359.138403620023,"Nb-Feruloyltryptamine","HMDB0041519","C20H20N2O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Na"]
[420,160.096911666065,"Homofureanol","HMDB0033736","C7H10O3","Organoheterocyclic compounds","Dihydrofurans","Furanones",null,"+NH4"]
[524,171.041606472392,"Cinnamic acid","HMDB0000567","C9H8O2","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acids","C10438","+Na"]
[2214,381.166893234175,"Normammein","HMDB0030784","C21H26O5","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins",null,"+Na"]
[1028,220.126962520723,"L-Coprine","HMDB0034266","C8H14N2O4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C08271","+NH4"]
[1361,257.168467656075,"1,2-Dimethyl-4-(6-methyl-4-heptenyl)-1,3-cyclohexadiene","HMDB0037740","C16H26","Hydrocarbons","Unsaturated hydrocarbons","Branched unsaturated hydrocarbons",null,"+K"]
[88,104.070972757204,"(S)-beta-Aminoisobutyric acid","HMDB0002166","C4H9NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C03284","+H"]
[2323,408.046926658242,"6-Hydroxy-R-acenocoumarol","HMDB0060882","C19H15NO7","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins",null,"+K"]
[1825,316.284329990697,"Dehydrophytosphingosine","HMDB0038057","C18H37NO3","Organic nitrogen compounds","Organonitrogen compounds","Amines",null,"+H"]
[969,213.088428251117,"Propyl cinnamate","HMDB0037700","C12H14O2","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acid esters","C06360","+Na"]
[1189,239.067771496214,"Artemidinol","HMDB0030647","C13H12O3","Phenylpropanoids and polyketides","Isocoumarins and derivatives",null,null,"+Na"]
[4675,611.18375909196,"5alpha-Ethoxy-6beta-hydroxy-5,6-dihydrophysalin B","HMDB0029626","C30H36O11","Lipids and lipid-like molecules","Steroids and steroid derivatives","Physalins and derivatives",null,"+K"]
[871,203.117699371741,"Tetrahydroharmol","HMDB0029835","C12H14N2O","Alkaloids and derivatives","Harmala alkaloids",null,null,"+H"]
[2136,366.227388576746,"3b-Hydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide","HMDB0032895","C20H28O5","Lipids and lipid-like molecules","Prenol lipids","Terpene lactones",null,"+NH4"]
[2324,408.141389775429,"Papaverrubine B","HMDB0030169","C21H23NO6","Alkaloids and derivatives","Rhoeadine alkaloids",null,null,"+Na"]
[1209,241.154402239647,"Dendrolasin","HMDB0036071","C15H22O","Lipids and lipid-like molecules","Prenol lipids","Monoterpenoids","C16779","+Na"]
[1495,274.165736612737,"1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol","HMDB0031772","C13H20O5","Benzenoids","Benzene and substituted derivatives","Phenylpropanes",null,"+NH4"]
[1051,222.148532644529,"cis-3-Hexenyl benzoate","HMDB0033379","C13H16O2","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives",null,"+NH4"]
[818,197.078238611489,"Isoxanthopterin","HMDB0000704","C6H5N5O2","Organoheterocyclic compounds","Pteridines and derivatives","Pterins and derivatives","C03975","+NH4"]
[1194,239.161543854551,"Dihydrozeatin","HMDB0012215","C10H15N5O","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C02029","+NH4"]
[1685,298.165891672156,"Nigellic acid","HMDB0036094","C15H20O5","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+NH4"]
[1503,275.120841624562,"Mintsulfide","HMDB0038151","C15H24S","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+K"]
[968,213.074658433873,"L-Arginine","HMDB0000517","C6H14N4O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00062","+K"]
[1667,296.148960029512,"11-Hydroxy-12-methoxydihydrokawain","HMDB0030766","C15H18O5","Phenylpropanoids and polyketides","Kavalactones",null,null,"+NH4"]
[2629,498.157305270186,"4'-O-Methylepicatechin 7-O-glucuronide","HMDB0029183","C22H24O12","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+NH4"]
[4674,611.120345687548,"2'',4'',6''-Triacetylglycitin","HMDB0034694","C28H28O13","Phenylpropanoids and polyketides","Isoflavonoids","Isoflavonoid O-glycosides",null,"+K"]
[870,203.104038521834,"Dihydroactinidiolide","HMDB0035240","C11H16O2","Organoheterocyclic compounds","Benzofurans",null,null,"+Na"]
[4676,611.218256860303,"Pelargonidin 3-sophoroside","HMDB0033679","C28H33O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides","C16305","+NH4"]
[1653,294.111870987187,"(R)-Higenamine","HMDB0033103","C16H17NO3","Organoheterocyclic compounds","Isoquinolines and derivatives","Benzylisoquinolines","C06346","+Na"]
[2127,365.105287270385,"Galabiose","HMDB0029902","C12H22O11","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C00760  ","+Na"]
[1716,302.106943467152,"Xanthosine","HMDB0000299","C10H12N4O6","Nucleosides, nucleotides, and analogues","Purine nucleosides",null,"C01762","+NH4"]
[454,163.122767651138,"Anabasine","HMDB0004350","C10H14N2","Alkaloids and derivatives",null,null,"C06180","+H"]
[722,189.134515265524,"L-Targinine","HMDB0029416","C7H16N4O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C03884","+H"]
[1192,239.125045845108,"N-Acetylgalactosamine","HMDB0000212","C8H15NO6","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C01074","+NH4"]
[113,108.08106385603,"3-Ethylpyridine","HMDB0029734","C7H9N","Organoheterocyclic compounds","Pyridines and derivatives",null,null,"+H"]
[2956,537.126726397889,"Jaceidin 4'-glucuronide","HMDB0031656","C24H24O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+H"]
[2137,366.263728746886,"[10]-Gingerdione","HMDB0029475","C21H32O4","Benzenoids","Phenols","Methoxyphenols",null,"+NH4"]
[1405,262.120060226403,"Tigloidine","HMDB0029875","C13H21NO2","Alkaloids and derivatives","Tropane alkaloids",null,"C10868","+K"]
[1502,275.089041086726,"Methyl 3,4,5-trimethoxycinnamate","HMDB0038551","C13H16O5","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Na"]
[2128,365.157015164094,"Jasmolone glucoside","HMDB0032870","C17H26O7","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Na"]
[2485,455.188066523349,"S-Furanopetasitin","HMDB0036131","C24H32O5S","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+Na"]
[1666,296.065488705347,"Pyro-L-glutaminyl-L-glutamine","HMDB0039229","C10H15N3O5","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+K"]
[203,131.117868374538,"2-Acetylpyrrolidine","HMDB0037293","C6H11NO","Organoheterocyclic compounds","Pyrrolidines",null,null,"+NH4"]
[610,273.07691420642,"(-)-Epiafzelechin","HMDB0030822","C15H14O5","Phenylpropanoids and polyketides","Flavonoids","Flavans","C12128","-H"]
[841,327.217673310637,"Corchorifatty acid F","HMDB0035919","C18H32O5","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"-H"]
[100,132.029283527087,"L-Aspartic acid","HMDB0000191","C4H7NO4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00049","-H"]
[840,327.108815850168,"Dihydromelilotoside","HMDB0038334","C15H20O8","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[360,207.014191053788,"Garcinia acid","HMDB0031159","C6H8O8","Organic acids and derivatives","Carboxylic acids and derivatives","Tricarboxylic acids and derivatives",null,"-H"]
[1086,409.202004374145,"(R)-Kanzonol Y","HMDB0031361","C25H30O5","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Chalcones and dihydrochalcones",null,"-H"]
[671,291.196692106103,"[7]-Paradol","HMDB0040806","C18H28O3","Benzenoids","Phenols","Methoxyphenols",null,"-H"]
[843,328.155523159731,"(S)-Reticuline","HMDB0003601","C19H23NO4","Organoheterocyclic compounds","Isoquinolines and derivatives","Benzylisoquinolines","C02105","-H"]
[159,147.02901102883,"L-2-Hydroxyglutaric acid","HMDB0000694","C5H8O5","Organic acids and derivatives","Hydroxy acids and derivatives","Short-chain hydroxy acids and derivatives","C03196","-H"]
[152,146.044993566784,"O-Acetylserine","HMDB0003011","C5H9NO4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00979","-H"]
[851,329.188886985435,"2-Hydroxylinolenic acid","HMDB0031103","C18H30O3","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"+Cl"]
[670,291.086801132848,"trans-Grandmarin","HMDB0039030","C15H16O6","Phenylpropanoids and polyketides","Coumarins and derivatives","Pyranocoumarins",null,"-H"]
[58,115.002587629777,"Maleic acid","HMDB0000176","C4H4O4","Organic acids and derivatives","Carboxylic acids and derivatives","Dicarboxylic acids and derivatives","C01384","-H"]
[114,134.046288980394,"(+)-threo-2-Amino-3,4-dihydroxybutanoic acid","HMDB0029389","C4H9NO4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"-H"]
[683,293.248712264175,"Methyl linoleate","HMDB0034381","C19H34O2","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"-H"]
[59,115.038982549542,"2-Oxovaleric acid","HMDB0001865","C5H8O3","Organic acids and derivatives","Keto acids and derivatives","Short-chain keto acids and derivatives","C06255","-H"]
[251,173.103776385747,"L-Arginine","HMDB0000517","C6H14N4O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00062","-H"]
[601,271.061237315685,"Toralactone","HMDB0038549","C15H12O5","Organoheterocyclic compounds","Naphthopyrans","Naphthopyranones","C17673","-H"]
[839,327.056423720854,"Cabbage identification factor 2","HMDB0033622","C15H12N4O3S","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"-H"]
[822,325.066825838253,"Osmundalin","HMDB0031304","C12H18O8","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Cl"]
[1292,517.230314224226,"6S,9R-Dihydroxy-4,7E-megastigmadien-3-one 9-[apiosyl-(1->6)-glucoside]","HMDB0029773","C24H38O12","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"-H"]
[696,187.072929725814,"Isoeugenol","HMDB0005802","C10H12O2","Benzenoids","Phenols","Methoxyphenols","C10469","+Na"]
[1355,257.041770312335,"7-Acetoxy-6-methoxycoumarin","HMDB0034345","C12H10O5","Phenylpropanoids and polyketides","Coumarins and derivatives",null,null,"+Na"]
[282,144.101889578748,"Proline betaine","HMDB0004827","C7H13NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C10172","+H"]
[1335,255.062480796041,"S-Cysteinosuccinic acid","HMDB0029418","C7H11NO6S","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+NH4"]
[694,187.036692939722,"Pantoic acid","HMDB0240389","C6H12O4","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C00522","+K"]
[608,178.133886548052,"Anatabine","HMDB0004476","C10H12N2","Organic nitrogen compounds","Organonitrogen compounds","Amines","C10126","+NH4"]
[606,178.081266208823,"O-Ureidohomoserine","HMDB0012271","C5H11N3O4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+H"]
[432,161.072996265079,"Santene","HMDB0038140","C9H14","Hydrocarbons","Unsaturated hydrocarbons","Branched unsaturated hydrocarbons",null,"+K"]
[2281,395.180729777864,"Isomammein","HMDB0030781","C22H28O5","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins",null,"+Na"]
[2282,395.218157371861,"Scutigeral","HMDB0030012","C23H32O4","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+Na"]
[1100,229.083516319117,"Ethyl trans-p-methoxycinnamate","HMDB0030762","C12H14O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acid esters","C10476","+Na"]
[1628,291.083780607831,"2,3-Butanediol glucoside","HMDB0040822","C10H20O7","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+K"]
[673,185.032188069939,"Ureidoisobutyric acid","HMDB0002031","C5H10N2O3","Organic acids and derivatives","Organic carbonic acids and derivatives","Ureas","C05100","+K"]
[1099,229.047014087143,"Mevalonic acid-5P","HMDB0001343","C6H13O7P","Organic acids and derivatives","Organic phosphoric acids and derivatives","Phosphate esters","C01107","+H"]
[2433,439.192656068283,"Ethyl 7-epi-12-hydroxyjasmonate glucoside","HMDB0036340","C20H32O9","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"+Na"]
[674,185.057246539836,"3-(4-Methoxyphenyl)-2-propenal","HMDB0032611","C10H10O2","Phenylpropanoids and polyketides","Cinnamaldehydes",null,"C10475","+Na"]
[1893,326.048529326427,"Clitocine","HMDB0033718","C9H13N5O6","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+K"]
[2385,422.165055400626,"Oleoside 11-methyl ester","HMDB0041550","C17H24O11","Lipids and lipid-like molecules","Prenol lipids","Terpene glycosides",null,"+NH4"]
[3421,558.094830311277,"Cyanidin 3-(6''-malonylglucoside)","HMDB0037974","C24H23O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+Na"]
[2280,395.151931264458,"Xanthoplanine","HMDB0033356","C21H26NO4","Alkaloids and derivatives","Aporphines",null,null,"+K"]
[1337,255.098975113338,"Marindinin","HMDB0029504","C14H16O3","Phenylpropanoids and polyketides","Kavalactones",null,null,"+Na"]
[549,173.057439614865,"4-Ethoxybenzaldehyde","HMDB0033970","C9H10O2","Benzenoids","Phenol ethers",null,null,"+Na"]
[1629,291.098824056113,"Eugenyl benzoate","HMDB0032056","C17H16O3","Phenylpropanoids and polyketides","Depsides and depsidones",null,null,"+Na"]
[5142,631.144360786103,"Isowertin 2''-rhamnoside","HMDB0037417","C28H32O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides","C12629","+K"]
[1891,325.177218649747,"19-Hydroxyandrost-4-ene-3,17-dione","HMDB0003955","C19H26O3","Lipids and lipid-like molecules","Steroids and steroid derivatives","Androstane steroids","C05290","+Na"]
[672,185.021379559928,"Adipic acid","HMDB0000448","C6H10O4","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C06104","+K"]
[605,178.068239733024,"1-Isothiocyanato-3-phenylpropane","HMDB0038444","C10H11NS","Benzenoids","Benzene and substituted derivatives",null,null,"+H"]
[459,164.073714549121,"S-Propyl-L-cysteine","HMDB0034324","C6H13NO2S","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+H"]
[2490,456.190707532144,"7-Hydroxy-5-(4-hydroxy-2-oxopentyl)-2-methylchromone 7-glucoside","HMDB0034698","C21H26O10","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+NH4"]
[1036,221.033766435712,"Imidazole acetol-phosphate","HMDB0012236","C6H9N2O5P","Organic acids and derivatives","Organic phosphoric acids and derivatives","Phosphate esters","C01267","+H"]
[1662,295.166511986985,"17a-Estradiol","HMDB0000429","C18H24O2","Lipids and lipid-like molecules","Steroids and steroid derivatives","Estrane steroids","C02537","+Na"]
[665,289.071735182238,"(-)-Catechin","HMDB0037953","C15H14O6","Phenylpropanoids and polyketides","Flavonoids","Flavans","C14079","-H"]
[1119,425.197144252951,"(3S,5R,6S,7E,9x)-7-Megastigmene-3,6,9-triol 9-glucoside","HMDB0041176","C19H34O8","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"+Cl"]
[1120,426.022246497475,"dGDP","HMDB0000960","C10H15N5O10P2","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives","C00361","-H"]
[729,305.215102546955,"[8]-Paradol","HMDB0040640","C19H30O3","Benzenoids","Phenols","Methoxyphenols",null,"-H"]
[722,303.051006050847,"Inosine","HMDB0000195","C10H12N4O5","Nucleosides, nucleotides, and analogues","Purine nucleosides",null,"C00294","+Cl"]
[669,291.077327764352,"Xenognosin A","HMDB0029539","C16H16O3","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Cinnamylphenols","C08731","+Cl"]
[569,259.097520305825,"Cyperine","HMDB0033771","C15H16O4","Benzenoids","Benzene and substituted derivatives","Diphenylethers","C09923","-H"]
[1608,845.217193458454,"Spinacetin 3-(2''-feruloylgentiobioside)","HMDB0031424","C39H42O21","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"-H"]
[1501,681.270729065225,"Myricanol 5-laminaribioside","HMDB0036528","C33H46O15","Lipids and lipid-like molecules","Prenol lipids","Triterpenoids",null,"-H"]
[733,307.030725644319,"cis-Resveratrol 3-sulfate","HMDB0041712","C14H12O6S","Phenylpropanoids and polyketides","Stilbenes",null,null,"-H"]
[903,343.129883455567,"Dihydrocumambrin A","HMDB0036489","C17H24O5","Lipids and lipid-like molecules","Prenol lipids","Terpene lactones",null,"+Cl"]
[621,275.201446722662,"Stearidonic acid","HMDB0006547","C18H28O2","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives","C16300","-H"]
[620,275.092122747763,"Lactucin","HMDB0035814","C15H16O5","Organoheterocyclic compounds","Lactones","Gamma butyrolactones","C09489","-H"]
[1313,533.181992810341,"N2-Maltulosylarginine","HMDB0041542","C18H34N4O12","Lipids and lipid-like molecules","Saccharolipids",null,null,"+Cl"]
[1116,423.181287280665,"Glisoflavanone","HMDB0030149","C25H28O6","Phenylpropanoids and polyketides","Isoflavonoids","Isoflavans",null,"-H"]
[1448,617.08885279537,"5'-Methoxybilobetin","HMDB0038101","C32H22O11","Phenylpropanoids and polyketides","Flavonoids","Biflavonoids and polyflavonoids",null,"+Cl"]
[1420,595.379445892702,"Capsorubinidione","HMDB0039091","C40H52O4","Lipids and lipid-like molecules","Prenol lipids","Triterpenoids",null,"-H"]
[1609,845.407632121676,"Azukisaponin III","HMDB0039352","C42H66O15","Lipids and lipid-like molecules","Prenol lipids","Terpene glycosides",null,"+Cl"]
[504,239.059470251014,"(±)-Tryptophan","HMDB0030396","C11H12N2O2","Organoheterocyclic compounds","Indoles and derivatives","Indolyl carboxylic acids and derivatives","C00806","+Cl"]
[1115,423.093297439441,"3-Glucosyl-2,3',4,4',6-pentahydroxybenzophenone","HMDB0032645","C19H20O11","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[1356,561.139973043603,"Epifisetinidol-(4beta->8)-catechin","HMDB0032007","C30H26O11","Phenylpropanoids and polyketides","Flavonoids","Biflavonoids and polyflavonoids",null,"-H"]
[482,233.154460710132,"Sugeonol","HMDB0041036","C15H22O2","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C17504","-H"]
[1289,517.101957718978,"6''-Malonylcosmosiin","HMDB0037346","C24H22O13","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"-H"]
[245,171.101993377955,"Butyl 3-hydroxy-2-methylidenebutanoate","HMDB0040202","C9H16O3","Organic acids and derivatives","Hydroxy acids and derivatives","Beta hydroxy acids and derivatives",null,"-H"]
[637,279.232866678642,"Linoleic acid","HMDB0000673","C18H32O2","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives","C01595","-H"]
[977,371.083169222141,"3-Hydroxymugineic acid","HMDB0033927","C12H20N2O9","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+Cl"]
[88,129.054735439909,"Ethyl acetoacetate","HMDB0031216","C6H10O3","Organic acids and derivatives","Keto acids and derivatives","Beta-keto acids and derivatives","C03500","-H"]
[636,279.038186563221,"Pseudouridine","HMDB0000767","C9H12N2O6","Nucleosides, nucleotides, and analogues","Nucleoside and nucleotide analogues",null,"C02067","+Cl"]
[542,249.078291619246,"Harmaline","HMDB0030310","C13H14N2O","Alkaloids and derivatives","Harmala alkaloids",null,"C06536","+Cl"]
[1011,385.259462804044,"Mangalkanyl glucoside","HMDB0036015","C21H38O6","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[1341,555.146659197758,"Citrusin F","HMDB0039235","C22H32O14","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Cl"]
[1531,278.185958558214,"Baptifoline","HMDB0033481","C15H20N2O2","Alkaloids and derivatives","Lupin alkaloids","Anagyrine-type alkaloids","C10755","+NH4"]
[1530,278.173891745553,"Dinorcapsaicin","HMDB0036325","C16H23NO3","Benzenoids","Phenols","Methoxyphenols",null,"+H"]
[202,131.106648563979,"Isopentyl acetate","HMDB0031528","C7H14O2","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acid derivatives","C12296","+H"]
[1858,321.130471143304,"Isomugineic acid","HMDB0033555","C12H20N2O8","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+H"]
[1859,321.145329015387,"Gravelliferone","HMDB0030729","C19H22O3","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins",null,"+Na"]
[210,132.113097310101,"N-Carbamoylputrescine","HMDB0033458","C5H13N3O","Organic acids and derivatives","Carboximidic acids and derivatives","Carboximidic acids","C00436","+H"]
[1359,257.13443869595,"Decarbamoylsaxitoxin","HMDB0038319","C9H16N6O3","Phenylpropanoids and polyketides","Saxitoxins, gonyautoxins, and derivatives",null,null,"+H"]
[1519,277.0820738377,"3,6-Dimethoxy-4-phenanthrenol","HMDB0029687","C16H14O3","Benzenoids","Phenanthrenes and derivatives","Phenanthrols",null,"+Na"]
[1140,233.078391860672,"Sinapyl alcohol","HMDB0013070","C11H14O4","Benzenoids","Phenols","Methoxyphenols","C02325","+Na"]
[294,145.133397731757,"Nor-psi-tropine","HMDB0031667","C7H13NO","Alkaloids and derivatives","Tropane alkaloids",null,null,"+NH4"]
[873,203.150190548472,"Asymmetric dimethylarginine","HMDB0001539","C8H18N4O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C03626","+H"]
[291,145.064805920401,"1-Naphthol","HMDB0012138","C10H8O","Benzenoids","Naphthalenes","Naphthols and derivatives","C11714","+H"]
[1141,233.093137062439,"Lactaroviolin","HMDB0035896","C15H14O","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C09696","+Na"]
[2330,409.183190822151,"Corchoionol C 9-glucoside","HMDB0029772","C19H30O8","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"+Na"]
[209,132.101910310307,"L-Isoleucine","HMDB0000172","C6H13NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00407","+H"]
[2204,379.200924568694,"Plastoquinone 3","HMDB0033786","C23H32O2","Lipids and lipid-like molecules","Prenol lipids","Diterpenoids",null,"+K"]
[1781,309.216849733571,"Norcapsaicin","HMDB0036327","C17H25NO3","Benzenoids","Phenols","Methoxyphenols",null,"+NH4"]
[2205,379.223802324981,"1-Formylneogrifolin","HMDB0039880","C23H32O3","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+Na"]
[2203,379.18551923663,"gamma-Crocetin","HMDB0035099","C22H28O4","Lipids and lipid-like molecules","Prenol lipids","Diterpenoids",null,"+Na"]
[2329,409.050203241764,"Shoyuflavone A","HMDB0034582","C19H14O9","Phenylpropanoids and polyketides","Isoflavonoids","Isoflav-2-enes",null,"+Na"]
[2144,367.22285717265,"Anacardic acid","HMDB0033896","C22H32O3","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives",null,"+Na"]
[234,137.059608855292,"Phenylacetic acid","HMDB0000209","C8H8O2","Benzenoids","Benzene and substituted derivatives",null,"C07086","+H"]
[1323,253.119693505347,"Cyclohexyl cinnamate","HMDB0037706","C15H18O2","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acid esters",null,"+Na"]
[1835,318.117963373078,"Dimethyl fukiic acid","HMDB0029497","C13H16O8","Benzenoids","Phenols","Benzenediols",null,"+NH4"]
[1339,255.135360592866,"Furanogermenone","HMDB0036766","C15H20O2","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C17488","+Na"]
[1836,318.135898082652,"Melilotocarpan A","HMDB0033142","C17H16O5","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00542","+NH4"]
[2578,483.145998599814,"Methyl salicylate O-[rhamnosyl-(1->6)-glucoside]","HMDB0033138","C20H28O12","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Na"]
[79,102.055345348862,"L-3-Aminodihydro-2(3H)-furanone","HMDB0029387","C4H7NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C02926","+H"]
[1676,297.146075981935,"[6]-Dehydroshogaol","HMDB0033090","C17H22O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Na"]
[1675,297.109619254842,"Rutacultin","HMDB0034132","C16H18O4","Phenylpropanoids and polyketides","Coumarins and derivatives",null,null,"+Na"]
[1265,247.176123125835,"Cuscohygrine","HMDB0030290","C13H24N2O","Alkaloids and derivatives",null,null,"C06521","+Na"]
[1321,253.083366168324,"Osthenol","HMDB0034130","C14H14O3","Phenylpropanoids and polyketides","Coumarins and derivatives","Hydroxycoumarins","C18080","+Na"]
[2575,482.274015507464,"Erinacine G","HMDB0029655","C25H36O8","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+NH4"]
[2583,485.072301175311,"Kaempferol 3-glucuronide","HMDB0029500","C21H18O12","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+Na"]
[1844,319.113182361298,"Deoxynivalenol","HMDB0036156","C15H20O6","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C09747","+Na"]
[2223,383.076656169656,"(+)-12a-Hydroxypachyrrhizone","HMDB0030774","C20H14O8","Phenylpropanoids and polyketides","Isoflavonoids","Rotenoids",null,"+H"]
[1037,221.057345413549,"Verimol J","HMDB0036522","C10H14O3","Benzenoids","Phenols","Methoxyphenols",null,"+K"]
[2220,382.155837207836,"N-Didesmethyl-tamoxifen","HMDB0061086","C24H25NO","Phenylpropanoids and polyketides","Stilbenes",null,"C16548","+K"]
[1890,325.154334539484,"N-Acetylanonaine","HMDB0030349","C19H17NO3","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acids",null,"+NH4"]
[849,201.052197215042,"4-Methoxycinnamic acid","HMDB0002040","C10H10O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acids",null,"+Na"]
[173,152.047530359697,"L-Valine","HMDB0000883","C5H11NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00183","+Cl"]
[633,277.217277292784,"alpha-Linolenic acid","HMDB0001388","C18H30O2","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives","C06427","-H"]
[93,130.086394694445,"L-Isoleucine","HMDB0000172","C6H13NO2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00407","-H"]
[141,143.106850352343,"Hexyl acetate","HMDB0029980","C8H16O2","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acid derivatives",null,"-H"]
[394,213.994096544356,"S-Carboxymethyl-L-cysteine","HMDB0029415","C5H9NO4S","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+Cl"]
[193,157.122600775557,"Heptyl acetate","HMDB0031480","C9H18O2","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acid derivatives",null,"-H"]
[985,373.186535871426,"6-Epi-7-isocucurbic acid glucoside","HMDB0029782","C18H30O8","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"-H"]
[1141,437.14503078629,"7-Hydroxy-5-(4-hydroxy-2-oxopentyl)-2-methylchromone 7-glucoside","HMDB0034698","C21H26O10","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[1418,595.134173781303,"Quercetin 3-arabinoside 7-glucoside","HMDB0037355","C26H28O16","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"-H"]
[1098,228.159225914283,"Jasmonic acid","HMDB0032797","C12H18O3","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives","C08491","+NH4"]
[1102,229.11979772346,"Hexyl benzoate","HMDB0040431","C13H18O2","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives","C14716","+Na"]
[3404,557.355145392651,"Pyrohyperforin","HMDB0035899","C35H50O4","Lipids and lipid-like molecules","Prenol lipids","Monoterpenoids",null,"+Na"]
[4292,595.167477361233,"Vicenin 2","HMDB0030708","C27H30O15","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides","C10195","+H"]
[5185,633.110743421167,"Myricetin 7-(6''-galloylglucoside)","HMDB0035463","C28H24O17","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+H"]
[2140,367.078836477171,"5,7-Dihydroxy-3',4',5'-trimethoxyflavone","HMDB0037692","C18H16O7","Phenylpropanoids and polyketides","Flavonoids","O-methylated flavonoids","C19807","+Na"]
[770,193.13351977684,"1-Undecene","HMDB0029551","C11H22","Hydrocarbons","Unsaturated hydrocarbons","Unsaturated aliphatic hydrocarbons",null,"+K"]
[967,213.052104843873,"Coixinden A","HMDB0040938","C11H10O3","Benzenoids","Indenes and isoindenes",null,"C17916","+Na"]
[4700,612.143723505996,"Delphinidin 3-(6-p-coumaroylgalactoside)","HMDB0037089","C30H27O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+H"]
[2923,535.192980346195,"Physalin M","HMDB0034342","C28H32O9","Lipids and lipid-like molecules","Steroids and steroid derivatives","Physalins and derivatives",null,"+Na"]
[2264,391.223752988813,"N-Jasmonoyltyrosine","HMDB0039503","C21H27NO5","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+NH4"]
[6619,705.191025688989,"Sesamose","HMDB0038871","C24H42O21","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08248","+K"]
[207,161.044730302192,"3-Hydroxymethylglutaric acid","HMDB0000355","C6H10O5","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C03761","-H"]
[5167,632.176243248829,"Peonidin 3-rhamnoside 5-glucoside","HMDB0038090","C28H33O15","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+Na"]
[2333,409.270954599774,"Apo-10'-violaxanthal","HMDB0039018","C27H36O3","Lipids and lipid-like molecules","Prenol lipids","Sesterterpenoids",null,"+H"]
[538,172.095185850267,"4-Hydroxy-3-methoxybenzenemethanol","HMDB0032012","C8H10O3","Benzenoids","Phenols","Methoxyphenols","C06317","+NH4"]
[5143,631.180576646236,"8-Acetoxy-4'-methoxypinoresinol 4-glucoside","HMDB0033278","C29H36O13","Lignans, neolignans and related compounds","Lignan glycosides",null,null,"+K"]
[3034,541.158432834226,"Isocycloheterophyllin","HMDB0029471","C30H30O7","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+K"]
[2310,405.189728979565,"Dihydroclusin","HMDB0033272","C22H28O7","Lignans, neolignans and related compounds","Dibenzylbutane lignans","Dibenzylbutanediol lignans",null,"+H"]
[619,275.082616110241,"Obtustyrene","HMDB0030672","C16H16O2","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Cinnamylphenols",null,"+Cl"]
[1334,547.03948748439,"UDP-4-dehydro-6-deoxy-D-glucose","HMDB0012300","C15H22N2O16P2","Nucleosides, nucleotides, and analogues","Pyrimidine nucleotides","Pyrimidine nucleotide sugars","C04089","-H"]
[1339,551.182430921221,"(Z)-Resveratrol 3,4'-diglucoside","HMDB0039910","C26H32O13","Phenylpropanoids and polyketides","Stilbenes","Stilbene glycosides",null,"-H"]
[1124,427.211954968863,"Austalide L","HMDB0030158","C25H32O6","Phenylpropanoids and polyketides","Flavonoids","Flavones",null,"-H"]
[1346,557.162640007681,"Physalin K","HMDB0034347","C28H30O12","Lipids and lipid-like molecules","Steroids and steroid derivatives","Physalins and derivatives",null,"-H"]
[159,122.081334440895,"Ethoxyacetic acid","HMDB0031212","C4H8O3","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acids",null,"+NH4"]
[2732,519.217854725899,"Citronellyl beta-sophoroside","HMDB0032839","C22H40O11","Lipids and lipid-like molecules","Prenol lipids","Terpene glycosides",null,"+K"]
[2731,519.191934602425,"Ciceritol","HMDB0032777","C19H34O16","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+H"]
[314,147.091509257305,"Indole-3-methanamine","HMDB0029740","C9H10N2","Organoheterocyclic compounds","Indoles and derivatives","Indoles",null,"+H"]
[217,133.060724392214,"Ureidopropionic acid","HMDB0000026","C4H8N2O3","Organic acids and derivatives","Organic carbonic acids and derivatives","Ureas","C02642","+H"]
[295,145.14464288626,"Homoagmatine","HMDB0031505","C6H16N4","Organic nitrogen compounds","Organonitrogen compounds","Guanidines",null,"+H"]
[243,138.091264706296,"Tyramine","HMDB0000306","C8H11NO","Benzenoids","Benzene and substituted derivatives","Phenethylamines","C00483","+H"]
[715,189.015843731638,"Phthalic acid","HMDB0002107","C8H6O4","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives","C01606","+Na"]
[1780,309.203289906203,"Methylgingerol","HMDB0029852","C18H28O4","Benzenoids","Benzene and substituted derivatives","Methoxybenzenes",null,"+H"]
[1109,230.123294471951,"D-Glycero-D-galacto-heptitol","HMDB0033750","C7H16O7","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08255","+NH4"]
[1746,306.131018422195,"5'-Methoxy-O-desmethylangolensin","HMDB0041686","C16H16O5","Phenylpropanoids and polyketides","Alpha-methyldeoxybenzoin flavonoids",null,null,"+NH4"]
[384,211.133571547991,"Dihydrojasmonic acid","HMDB0033601","C12H20O3","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"-H"]
[644,281.248493072931,"Elaidic acid","HMDB0000573","C18H34O2","Lipids and lipid-like molecules","Fatty Acyls","Fatty acids and conjugates","C01712","-H"]
[632,277.072214058757,"D-erythro-D-galacto-octitol","HMDB0029953","C8H18O8","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+Cl"]
[589,267.160178410627,"4,11,13,15-Tetrahydroridentin B","HMDB0036150","C15H24O4","Lipids and lipid-like molecules","Prenol lipids","Terpene lactones",null,"-H"]
[282,185.117740977318,"(E)-10-Hydroxy-8-decenoic acid","HMDB0039533","C10H18O3","Organic acids and derivatives","Hydroxy acids and derivatives","Medium-chain hydroxy acids and derivatives",null,"-H"]
[208,161.063237842232,"3-Mercapto-3-methyl-1-butyl acetate","HMDB0039227","C7H14O2S","Organic acids and derivatives","Carboxylic acids and derivatives","Carboxylic acid derivatives",null,"-H"]
[206,160.060719562122,"Aminoadipic acid","HMDB0000510","C6H11NO4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00956","-H"]
[890,205.097050624986,"(±)-Tryptophan","HMDB0030396","C11H12N2O2","Organoheterocyclic compounds","Indoles and derivatives","Indolyl carboxylic acids and derivatives","C00806","+H"]
[2142,367.154913365152,"Curcumin II","HMDB0039610","C22H22O5","Benzenoids","Phenols","Methoxyphenols",null,"+H"]
[886,205.04703053629,"1-Deoxy-D-glucitol","HMDB0041500","C6H14O5","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+K"]
[987,215.067668792164,"Methyl trans-p-methoxycinnamate","HMDB0030752","C11H12O3","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Cinnamic acid esters",null,"+Na"]
[205,159.98549410838,"Taurine","HMDB0000251","C2H7NO3S","Organic acids and derivatives","Organic sulfonic acids and derivatives","Organosulfonic acids and derivatives","C00245","+Cl"]
[209,161.080902022771,"Dimethicone","HMDB0033532","C6H18OSi2","Organometallic compounds","Organometalloid compounds","Organosilicon compounds",null,"-H"]
[188,155.106914659425,"Dihydro-5-pentyl-2(3H)-furanone","HMDB0031531","C9H16O2","Organoheterocyclic compounds","Lactones","Gamma butyrolactones",null,"-H"]
[464,229.049571393827,"Caffeine","HMDB0001847","C8H10N4O2","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C07481","+Cl"]
[809,323.028590319336,"Pseudouridine 5'-phosphate","HMDB0001271","C9H13N2O9P","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C01168","-H"]
[411,218.103071674822,"Zeatin","HMDB0012204","C10H13N5O","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C00371","-H"]
[1190,465.102683187049,"Glucodistylin","HMDB0041597","C21H22O12","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"-H"]
[2222,382.221377220058,"Cinncassiol C2","HMDB0035168","C20H28O6","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids","C17642","+NH4"]
[1352,559.196577193459,"Gibberellin A38 glucosyl ester","HMDB0036903","C26H36O11","Lipids and lipid-like molecules","Prenol lipids","Terpene glycosides",null,"+Cl"]
[461,164.106998617615,"4-Phenyl-2-butenal","HMDB0029602","C10H10O","Benzenoids","Benzene and substituted derivatives",null,null,"+NH4"]
[2273,393.2391351099,"Antibiotic SB 202742","HMDB0041206","C24H34O3","Benzenoids","Benzene and substituted derivatives","Benzoic acids and derivatives",null,"+Na"]
[2321,407.203691407124,"Cinnzeylanol","HMDB0036010","C20H32O7","Lipids and lipid-like molecules","Prenol lipids","Diterpenoids",null,"+Na"]
[2325,408.183133752173,"Mesuagin","HMDB0035876","C24H22O5","Phenylpropanoids and polyketides","Neoflavonoids","Prenylated neoflavonoids",null,"+NH4"]
[1298,521.133502703391,"Salviaflaside","HMDB0033705","C24H26O13","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"-H"]
[659,287.056149864005,"Norartocarpanone","HMDB0037314","C15H12O6","Phenylpropanoids and polyketides","Flavonoids","Flavans",null,"-H"]
[1326,542.171346344174,"Epirubicin","HMDB0014588","C27H29NO11","Phenylpropanoids and polyketides","Anthracyclines",null,"C11230","-H"]
[530,245.081690387908,"Torachrysone","HMDB0038473","C14H14O4","Benzenoids","Naphthalenes","Naphthols and derivatives","C17672","-H"]
[658,287.032458267409,"2-O-(Z-p-Hydroxycinnamoyl)-(x)-glyceric acid","HMDB0041195","C12H12O6","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+Cl"]
[1391,577.135390636478,"Epicatechin-(6'->8)-epicatechin","HMDB0032900","C30H26O12","Phenylpropanoids and polyketides","Flavonoids","Flavans",null,"-H"]
[2284,396.171858780874,"N-Desmethyltamoxifen","HMDB0013866","C25H27NO","Phenylpropanoids and polyketides","Stilbenes",null,"C16546","+K"]
[1856,320.221810036507,"Homocapsaicin","HMDB0036329","C19H29NO3","Benzenoids","Phenols","Methoxyphenols",null,"+H"]
[547,173.020857928923,"4-Hydroxyphthalide","HMDB0032598","C8H6O3","Organoheterocyclic compounds","Isocoumarans","Isobenzofuranones",null,"+Na"]
[261,141.065207753865,"2-Hydroxy-4-imino-2,5-cyclohexadienone","HMDB0031713","C6H5NO2","Organic nitrogen compounds","Organonitrogen compounds","Quinonimines",null,"+NH4"]
[240,138.054785837745,"Trigonelline","HMDB0000875","C7H7NO2","Alkaloids and derivatives",null,null,"C01004","+H"]
[1518,277.063838162811,"4'-Methoxychalcone","HMDB0032585","C16H14O2","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Chalcones and dihydrochalcones",null,"+K"]
[1466,270.182593926614,"Neoherculin","HMDB0030955","C16H25NO","Organic acids and derivatives","Carboximidic acids and derivatives","Carboximidic acids",null,"+Na"]
[313,193.034796830956,"Galacturonic acid","HMDB0002545","C6H10O7","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08348","-H"]
[4677,611.266347412213,"Ganoderic acid H","HMDB0035987","C32H44O9","Lipids and lipid-like molecules","Prenol lipids","Triterpenoids",null,"+K"]
[1017,219.026392523146,"Theophylline","HMDB0001889","C7H8N4O2","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C07130","+K"]
[1019,219.053643478077,"L-2-Amino-3-(4-aminophenyl)propanoic acid","HMDB0030397","C9H12N2O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues",null,"+K"]
[820,197.114597519351,"beta-D-Glucosamine","HMDB0030091","C6H13NO5","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08349","+NH4"]
[332,150.07736808909,"3-Methyladenine","HMDB0011600","C6H7N5","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C00913","+H"]
[1490,669.056563974079,"Corilagin","HMDB0031457","C27H22O18","Phenylpropanoids and polyketides","Tannins","Hydrolyzable tannins","C10219","+Cl"]
[1174,457.18681994213,"1-Octen-3-yl primeveroside","HMDB0032960","C19H34O10","Lipids and lipid-like molecules","Fatty Acyls","Fatty acyl glycosides",null,"+Cl"]
[1180,461.184570203574,"13-Hydroxy-5'-O-methylmelledonal","HMDB0035864","C24H30O9","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"-H"]
[642,281.139463003567,"Cynaratriol","HMDB0034983","C15H22O5","Lipids and lipid-like molecules","Prenol lipids","Terpene lactones",null,"-H"]
[1350,559.077124462844,"Sennidin C","HMDB0034318","C30H20O9","Benzenoids","Anthracenes","Anthracenecarboxylic acids and derivatives","C16797","+Cl"]
[306,146.16504873327,"Spermidine","HMDB0001257","C7H19N3","Organic nitrogen compounds","Organonitrogen compounds","Amines","C00315","+H"]
[305,146.117522557242,"1-Methoxy-3-methylene-2-pentanone","HMDB0030330","C7H12O2","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates",null,"+NH4"]
[1095,411.133262043008,"Kanzonol V","HMDB0029788","C24H24O4","Phenylpropanoids and polyketides","2-arylbenzofuran flavonoids",null,null,"+Cl"]
[1005,383.149974771322,"Glicoisoflavanone","HMDB0035427","C22H24O6","Phenylpropanoids and polyketides","Flavonoids","Flavans",null,"-H"]
[1152,441.191734552851,"Kiwiionoside","HMDB0038691","C19H34O9","Lipids and lipid-like molecules","Prenol lipids","Terpene glycosides",null,"+Cl"]
[1098,412.136881948282,"(-)-alpha-Narcotine","HMDB0033439","C22H23NO7","Alkaloids and derivatives","Phthalide isoquinolines",null,"C09592","-H"]
[529,245.043248202681,"​D-manno-2-Heptulose","HMDB0029935","C7H14O7","Organic oxygen compounds","Organooxygen compounds","Carbohydrates and carbohydrate conjugates","C08236","+Cl"]
[1081,407.186571371846,"3-Hydroxyglabrol","HMDB0029532","C25H28O5","Phenylpropanoids and polyketides","Flavonoids","Flavans",null,"-H"]
[6158,680.191981762172,"Kaempferol 3-(2'',3''-diacetyl-4''-p-coumaroylrhamnoside)","HMDB0040537","C34H30O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides",null,"+NH4"]
[316,147.112705159557,"L-Lysine","HMDB0000182","C6H14N2O2","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C00047","+H"]
[1077,225.071665629323,"2-Amino-4-hydroxy-6-pteridinecarboxylic acid","HMDB0033136","C7H5N5O3","Organoheterocyclic compounds","Pteridines and derivatives","Pterins and derivatives",null,"+NH4"]
[1837,318.168100242859,"Myrigalone E","HMDB0030755","C18H20O4","Phenylpropanoids and polyketides","Linear 1,3-diarylpropanoids","Chalcones and dihydrochalcones",null,"+NH4"]
[1889,325.104350161887,"(R)-3',7-Dihydroxy-2',4'-dimethoxyisoflavan","HMDB0030717","C17H18O5","Phenylpropanoids and polyketides","Isoflavonoids","O-methylated isoflavonoids",null,"+Na"]
[1176,237.145913352569,"Zeatin","HMDB0012204","C10H13N5O","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C00371","+NH4"]
[126,112.08713808195,"Histamine","HMDB0000870","C5H9N3","Organic nitrogen compounds","Organonitrogen compounds","Amines","C00388","+H"]
[1079,225.109272921641,"Oxalic acid dibutyl ester","HMDB0040196","C10H18O4","Organic acids and derivatives","Carboxylic acids and derivatives","Dicarboxylic acids and derivatives",null,"+Na"]
[874,203.222851280815,"Spermine","HMDB0001256","C10H26N4","Organic nitrogen compounds","Organonitrogen compounds","Amines","C00750","+H"]
[769,193.11987373597,"Citronellic acid","HMDB0035837","C10H18O2","Lipids and lipid-like molecules","Prenol lipids","Monoterpenoids","C16462","+Na"]
[126,137.034705870498,"Urocanic acid","HMDB0000301","C6H6N2O2","Organoheterocyclic compounds","Azoles","Imidazoles","C00785","-H"]
[1052,399.144807572798,"Hemiariensin","HMDB0029869","C22H24O7","Lignans, neolignans and related compounds","Dibenzylbutane lignans",null,null,"-H"]
[1842,319.047239082259,"3,3',4',5,5',8-Hexahydroxyflavone","HMDB0037357","C15H10O8","Phenylpropanoids and polyketides","Flavonoids","Flavones",null,"+H"]
[1094,411.046284202704,"Limocitrol","HMDB0037691","C18H16O9","Phenylpropanoids and polyketides","Flavonoids","Flavones",null,"+Cl"]
[4293,595.19755117443,"Poncirin","HMDB0037487","C28H34O14","Phenylpropanoids and polyketides","Flavonoids","Flavonoid glycosides","C09830","+H"]
[1380,259.108307625785,"Hexyl phenylacetate","HMDB0037714","C14H20O2","Benzenoids","Benzene and substituted derivatives",null,null,"+K"]
[2403,429.198832042925,"7-Formyldehydrothalicsimidine","HMDB0033097","C23H25NO6","Alkaloids and derivatives","Aporphines",null,null,"+NH4"]
[1683,298.12831321041,"Gravolenic acid","HMDB0033884","C14H16O6","Phenylpropanoids and polyketides","Cinnamic acids and derivatives","Hydroxycinnamic acids and derivatives",null,"+NH4"]
[2265,391.258793771999,"12'-Apo-b-carotene-3,12'-diol","HMDB0036054","C25H36O2","Lipids and lipid-like molecules","Prenol lipids","Diterpenoids",null,"+Na"]
[2055,351.192243583966,"12-Methoxy-8,11,13-abietatrien-20,11-olide","HMDB0038391","C21H28O3","Benzenoids","Phenanthrenes and derivatives",null,null,"+Na"]
[812,323.186489552448,"Cibaric acid","HMDB0038580","C18H28O5","Lipids and lipid-like molecules","Fatty Acyls","Lineolic acids and derivatives",null,"-H"]
[1378,571.141866665473,"2'',4'',6''-Triacetylglycitin","HMDB0034694","C28H28O13","Phenylpropanoids and polyketides","Isoflavonoids","Isoflavonoid O-glycosides",null,"-H"]
[1853,320.170591452034,"Garcinia lactone dibutyl ester","HMDB0040462","C14H22O7","Organic acids and derivatives","Carboxylic acids and derivatives","Tricarboxylic acids and derivatives",null,"+NH4"]
[685,186.09115063948,"Capillin","HMDB0032867","C12H8O","Benzenoids","Benzene and substituted derivatives","Benzoyl derivatives","C08398","+NH4"]
[684,186.060730252373,"Uric acid","HMDB0000289","C5H4N4O3","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C00366","+NH4"]
[468,230.021129345268,"Leucodopachrome","HMDB0004067","C9H9NO4","Organoheterocyclic compounds","Indoles and derivatives","Indolecarboxylic acids and derivatives","C05604","+Cl"]
[2286,397.175595443838,"11,12-Dimethoxy-8,11,13-abietatrien-20,7-olide","HMDB0035856","C22H30O4","Lipids and lipid-like molecules","Prenol lipids","Terpene lactones",null,"+K"]
[1497,274.237186758599,"Ipomeatetrahydrofuran","HMDB0040904","C15H28O3","Lipids and lipid-like molecules","Prenol lipids","Sesquiterpenoids",null,"+NH4"]
[1007,217.091914004863,"(S)-Isowillardiine","HMDB0030376","C7H9N3O4","Organic acids and derivatives","Carboxylic acids and derivatives","Amino acids, peptides, and analogues","C08289","+NH4"]
[508,169.083389334085,"Guanine","HMDB0000132","C5H5N5O","Organoheterocyclic compounds","Imidazopyrimidines","Purines and purine derivatives","C00242","+NH4"]