1.0 2010-04-08 22:09:13 UTC 2025-11-18 23:20:55 UTC FDB010620 5,9-Epidioxy-3-hydroxyergost-7-en-6-one Constituent of Hypsizygus marmoreus (bunashimeji). 5,9-Epidioxy-3-hydroxyergost-7-en-6-one is found in mushrooms. 5,9-Epidioxy-3-hydroxy-24-methylcholest-7-en-6-one 5,9-Epidioxy-3-hydroxyergost-7-en-6-one C28H44O4 444.6466 444.323959896 8-(5,6-dimethylheptan-2-yl)-16-hydroxy-9,13-dimethyl-18,19-dioxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-3-en-2-one 8-(5,6-dimethylheptan-2-yl)-16-hydroxy-9,13-dimethyl-18,19-dioxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-3-en-2-one 211486-17-8 CC(C)C(C)CCC(C)C1CCC2C3=CC(=O)C45CC(O)CCC4(C)C3(CCC12C)OO5 InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28-16-20(29)11-12-26(28,6)27(23,31-32-28)14-13-25(21,22)5/h15,17-22,29H,7-14,16H2,1-6H3 FZOPHVRKJMCTDV-UHFFFAOYSA-N belongs to the class of organic compounds known as ergostane steroids. These are steroids with a structure based on the ergostane skeleton, which arises from the methylation of cholestane at the 24-position. Ergostane steroids Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Ergostane steroids Aliphatic heteropolycyclic compounds 1,2-dioxolanes Cyclic alcohols and derivatives Cyclohexenones Dialkyl peroxides Hydrocarbon derivatives Oxacyclic compounds Secondary alcohols Alcohol Aliphatic heteropolycyclic compound Carbonyl group Cyclic alcohol Cyclohexenone Dialkyl peroxide Ergostane-skeleton Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Ortho-dioxolane Oxacycle Secondary alcohol logp 5.84 ALOGPS logs -6.16 ALOGPS solubility 3.08e-04 g/l ALOGPS logp 6.36 ChemAxon pka_strongest_acidic 15.14 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac 8-(5,6-dimethylheptan-2-yl)-16-hydroxy-9,13-dimethyl-18,19-dioxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-3-en-2-one ChemAxon average_mass 444.6466 ChemAxon mono_mass 444.323959896 ChemAxon smiles CC(C)C(C)CCC(C)C1CCC2C3=CC(=O)C45CC(O)CCC4(C)C3(CCC12C)OO5 ChemAxon formula C28H44O4 ChemAxon inchi InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28-16-20(29)11-12-26(28,6)27(23,31-32-28)14-13-25(21,22)5/h15,17-22,29H,7-14,16H2,1-6H3 ChemAxon inchikey FZOPHVRKJMCTDV-UHFFFAOYSA-N ChemAxon polar_surface_area 55.76 ChemAxon refractivity 126.11 ChemAxon polarizability 53.08 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 9446 Specdb::CMs 42903 Specdb::CMs 146414 Specdb::MsMs 87510 Specdb::MsMs 87511 Specdb::MsMs 87512 Specdb::MsMs 150030 Specdb::MsMs 150031 Specdb::MsMs 150032 Specdb::MsMs 2430640 Specdb::MsMs 2430641 Specdb::MsMs 2430642 Specdb::MsMs 2508985 Specdb::MsMs 2508986 Specdb::MsMs 2508987 HMDB32667 #<Reference:0x000055ce316ea320> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322