{"ymdb_id":"YMDB01515","created_at":"2011-07-29T00:46:18.000Z","updated_at":"2016-10-18T17:12:03.000Z","name":"beta-Carotene","cas":"7235-40-7","state":"Solid","melting_point":"183 oC","description":"beta-Carotene is a strongly-coloured red-orange pigment abundant in plants and fruits. It is a vitamin A precursor.","experimental_water_solubility":"0.0006 mg/mL [GREEN,FJ (1991)]","experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"17579","hmdb_id":"HMDB00561","kegg_id":"C02094","pubchem_id":"5280489","cs_id":"25995493","foodb_id":null,"wikipedia_link":null,"biocyc_id":"CPD1F-129","iupac":"1,3,3-trimethyl-2-[(1E,3E,5E,7E,9Z,11Z,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-1-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-1-ene","traditional_iupac":"1,3,3-trimethyl-2-[(1E,3E,5E,7E,9Z,11Z,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-1-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-1-ene","logp":"11.124081100000001","pka":null,"alogps_solubility":"3.91e-04 g/l","alogps_logp":"9.72","alogps_logs":"-6.14","acceptor_count":"0","donor_count":"0","rotatable_bond_count":"10","polar_surface_area":"0.0","refractivity":"191.61180000000004","polarizability":"70.97763114319031","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":null,"pka_strongest_acidic":null,"bioavailability":"0","number_of_rings":"2","rule_of_five":"0","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":[".beta. Carotene",".beta.,.beta.-Carotene","1,1'-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaene-1,18-diyl]bis(2,6,6-trimethylcyclohexene)","all-E-b-Carotene","all-E-beta-Carotene","all-epsilon-beta-Carotene","all-trans-\u0026beta","all-trans-b-Carotene","all-trans-beta-Carotene","b-Carotene","beta-Carotene","beta-Carotene, all-trans-","beta-Karotin","beta,beta-Carotene","Betacarotene","Carotaben","Carotene","CAROTENE, \u0026beta","CAROTENE, beta","Karotin","KPMK","Lucaratin","Lucarotin","Lurotin","Provatene","Provatenol","Provitamin A","Rovimix b-carotene","Serlabo","Solatene","trans-beta-Carotene"],"pathways":[],"growth_conditions":[{"growth_media":"grape juice","concentration":"0.019","concentration_units":"\u0026#181;M","error":"0.0"}],"references":[{"pubmed_id":null,"citation":"Alcoholic beverage, wine, table, red - U.S. Department of Agriculture, Agricultural Research Service. 2010. USDA National Nutrient Database for Standard Reference, Release 23. \u003ca href = http://www.ars.usda.gov/ba/bhnrc/ndl\u003eNutrient Data Laboratory Home Page\u003c/a\u003e"}],"proteins":[]}