1.0 2010-04-08 22:10:59 UTC 2019-11-26 03:09:18 UTC FDB013926 Anhydrosophoradiol Isolated from azuki bean (Vigna angularis) seeds. Anhydrosophoradiol is found in pulses. Anhydrosophoradiol C30H48O 424.7015 424.370516158 4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,11,12,12a,14,14a,14b-octadecahydropicen-3-ol 4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,12,12a,14,14a-dodecahydropicen-3-ol 86425-22-1 CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)C=C1 InChI=1S/C30H48O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,15-16,21-24,31H,10-14,17-19H2,1-8H3 DAYKSLOBCZJGHS-UHFFFAOYSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Triterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Triterpenoids Aliphatic homopolycyclic compounds Cyclic alcohols and derivatives Hydrocarbon derivatives Secondary alcohols Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Secondary alcohol Triterpenoid logp 7.11 ALOGPS logs -6.82 ALOGPS solubility 6.48e-05 g/l ALOGPS melting_point Mp 180-181° logp 7.04 ChemAxon pka_strongest_acidic 19.49 ChemAxon pka_strongest_basic -0.84 ChemAxon iupac 4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,11,12,12a,14,14a,14b-octadecahydropicen-3-ol ChemAxon average_mass 424.7015 ChemAxon mono_mass 424.370516158 ChemAxon smiles CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)C=C1 ChemAxon formula C30H48O ChemAxon inchi InChI=1S/C30H48O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,15-16,21-24,31H,10-14,17-19H2,1-8H3 ChemAxon inchikey DAYKSLOBCZJGHS-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 133.02 ChemAxon polarizability 53.39 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16616 Specdb::CMs 44290 Specdb::CMs 147790 Specdb::MsMs 12047 Specdb::MsMs 12048 Specdb::MsMs 12049 Specdb::MsMs 18719 Specdb::MsMs 18720 Specdb::MsMs 18721 Specdb::MsMs 2672717 Specdb::MsMs 2672718 Specdb::MsMs 2672719 Specdb::MsMs 3032462 Specdb::MsMs 3032463 Specdb::MsMs 3032464 HMDB35265 #<Reference:0x000055ce3357ef48> Pulses Unknown generic