{"ymdb_id":"YMDB01713","created_at":"2011-08-31T03:38:52.000Z","updated_at":"2016-09-08T18:37:02.000Z","name":"Hopeaphenol","cas":"17912-85-5","state":null,"melting_point":null,"description":"Hopeaphenol is a stilbenoid. It is a resveratrol tetramer isolated from wines.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"637848","cs_id":"23189501","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(1R,8S,9R,16R)-8,16-bis(4-hydroxyphenyl)-9-[(1R,8R,9S,16R)-4,6,12-trihydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,10,12,14(17)-hexaen-9-yl]-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,10,12,14(17)-hexaene-4,6,12-triol","traditional_iupac":"(1R,8S,9R,16R)-8,16-bis(4-hydroxyphenyl)-9-[(1R,8R,9S,16R)-4,6,12-trihydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,10,12,14(17)-hexaen-9-yl]-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,10,12,14(17)-hexaene-4,6,12-triol","logp":"10.430361719333334","pka":"9.06939105531777","alogps_solubility":"1.25e-03 g/l","alogps_logp":"6.06","alogps_logs":"-5.86","acceptor_count":"12","donor_count":"10","rotatable_bond_count":"5","polar_surface_area":"220.75999999999996","refractivity":"253.10999999999996","polarizability":"92.80320781949632","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-5.4537973259753665","pka_strongest_acidic":"8.690628616990859","bioavailability":"0","number_of_rings":"12","rule_of_five":"0","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":[],"pathways":[],"growth_conditions":[],"references":[],"proteins":[]}