1.0 2010-04-08 22:10:18 UTC 2025-11-18 23:38:50 UTC FDB012691 6-Deoxodolichosterone Constituent of Phaseolus vulgaris (kidney bean) and Dolichos lablab (hyacinth bean). 6-Deoxodolichosterone is found in many foods, some of which are common bean, hyacinth bean, pulses, and yellow wax bean. 5a-Ergost-24(28)-ene-2a,3a,22R,23R-tetrol, 9CI 6-Deoxodolichosterone C28H48O4 448.6783 448.355260024 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-4,5-diol 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-4,5-diol 87833-55-4 CC(C)C(=C)C(O)C(O)C(C)C1CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC12C InChI=1S/C28H48O4/c1-15(2)16(3)25(31)26(32)17(4)20-9-10-21-19-8-7-18-13-23(29)24(30)14-28(18,6)22(19)11-12-27(20,21)5/h15,17-26,29-32H,3,7-14H2,1-2,4-6H3 YCYJLHFHRKUCQX-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 Cyclic alcohols and derivatives Ergosterols and derivatives Hydrocarbon derivatives Secondary alcohols 2-hydroxysteroid 22-hydroxysteroid 23-hydroxysteroid 3-hydroxysteroid Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Ergostane-skeleton Ergosterol-skeleton Hydrocarbon derivative Hydroxysteroid Organic oxygen compound Organooxygen compound Secondary alcohol Tetrahydroxy bile acid, alcohol, or derivatives logp 3.63 ALOGPS logs -4.33 ALOGPS solubility 2.11e-02 g/l ALOGPS melting_point Mp 219-220.5° logp 4.16 ChemAxon pka_strongest_acidic 13.31 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 14-(3,4-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-4,5-diol ChemAxon average_mass 448.6783 ChemAxon mono_mass 448.355260024 ChemAxon smiles CC(C)C(=C)C(O)C(O)C(C)C1CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC12C ChemAxon formula C28H48O4 ChemAxon inchi InChI=1S/C28H48O4/c1-15(2)16(3)25(31)26(32)17(4)20-9-10-21-19-8-7-18-13-23(29)24(30)14-28(18,6)22(19)11-12-27(20,21)5/h15,17-26,29-32H,3,7-14H2,1-2,4-6H3 ChemAxon inchikey YCYJLHFHRKUCQX-UHFFFAOYSA-N ChemAxon polar_surface_area 80.92 ChemAxon refractivity 128.25 ChemAxon polarizability 54.35 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24660 Specdb::CMs 43821 Specdb::CMs 157246 Specdb::MsMs 62766 Specdb::MsMs 62767 Specdb::MsMs 62768 Specdb::MsMs 119565 Specdb::MsMs 119566 Specdb::MsMs 119567 Specdb::MsMs 2272245 Specdb::MsMs 2272246 Specdb::MsMs 2272247 Specdb::MsMs 3069684 Specdb::MsMs 3069685 Specdb::MsMs 3069686 HMDB34332 #<Reference:0x000055ce3226d1e8> Common bean Type 1 specific Phaseolus vulgaris 3885 Green bean Type 1 specific Phaseolus vulgaris 3885 Hyacinth bean Type 1 specific Lablab purpureus 35936 Pulses Unknown generic Yellow wax bean Type 1 specific Phaseolus vulgaris 3885