1.0 2010-04-08 22:10:19 UTC 2025-11-18 23:38:52 UTC FDB012696 Dolichosterone Constituent of Dolichos lablab (hyacinth bean). Dolichosterone is found in many foods, some of which are yellow wax bean, common bean, rice, and green bean. Dolichosterone C28H46O5 462.6618 462.334524582 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one 85797-15-5 CC(C)C(=C)C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C InChI=1S/C28H46O5/c1-14(2)15(3)25(32)26(33)16(4)18-7-8-19-17-11-22(29)21-12-23(30)24(31)13-28(21,6)20(17)9-10-27(18,19)5/h14,16-21,23-26,30-33H,3,7-13H2,1-2,4-6H3 CYPKCRFYMBXYBU-UHFFFAOYSA-N belongs to the class of organic compounds known as tetrahydroxy bile acids, alcohols and derivatives. These are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. Tetrahydroxy bile acids, alcohols and derivatives Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Bile acids, alcohols and derivatives Aliphatic homopolycyclic compounds 3-hydroxysteroids 6-oxosteroids Cyclic alcohols and derivatives Ecdysteroids Ergosterols and derivatives Hydrocarbon derivatives Ketones Organic oxides Secondary alcohols 2-hydroxysteroid 22-hydroxysteroid 23-hydroxysteroid 3-hydroxysteroid 6-oxosteroid Alcohol Aliphatic homopolycyclic compound Carbonyl group Cyclic alcohol Ecdysteroid Ergostane-skeleton Ergosterol-skeleton Hydrocarbon derivative Hydroxysteroid Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxosteroid Secondary alcohol Tetrahydroxy bile acid, alcohol, or derivatives logp 2.72 ALOGPS logs -4.02 ALOGPS solubility 4.46e-02 g/l ALOGPS melting_point Mp 233-237° logp 3.23 ChemAxon pka_strongest_acidic 13.31 ChemAxon pka_strongest_basic -3.2 ChemAxon iupac 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one ChemAxon average_mass 462.6618 ChemAxon mono_mass 462.334524582 ChemAxon smiles CC(C)C(=C)C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C ChemAxon formula C28H46O5 ChemAxon inchi InChI=1S/C28H46O5/c1-14(2)15(3)25(32)26(33)16(4)18-7-8-19-17-11-22(29)21-12-23(30)24(31)13-28(21,6)20(17)9-10-27(18,19)5/h14,16-21,23-26,30-33H,3,7-13H2,1-2,4-6H3 ChemAxon inchikey CYPKCRFYMBXYBU-UHFFFAOYSA-N ChemAxon polar_surface_area 97.99 ChemAxon refractivity 128.92 ChemAxon polarizability 54.57 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 5 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 18329 Specdb::CMs 43824 Specdb::CMs 131748 Specdb::CMs 139482 Specdb::MsMs 43713 Specdb::MsMs 43714 Specdb::MsMs 43715 Specdb::MsMs 171702 Specdb::MsMs 171703 Specdb::MsMs 171704 Specdb::MsMs 2693477 Specdb::MsMs 2693478 Specdb::MsMs 2693479 Specdb::MsMs 2984735 Specdb::MsMs 2984736 Specdb::MsMs 2984737 HMDB34336 #<Reference:0x000055ce32519a40> Broad bean Type 1 specific Vicia faba 3906 Common bean Type 1 specific Phaseolus vulgaris 3885 Corn Type 1 specific Zea mays 4577 Green bean Type 1 specific Phaseolus vulgaris 3885 Hyacinth bean Type 1 specific Lablab purpureus 35936 Pulses Unknown generic Rice Type 1 specific Oryza sativa 4530 0.84 0.84 0.84 mg/100 g Yellow wax bean Type 1 specific Phaseolus vulgaris 3885