1.0 2010-04-08 22:10:54 UTC 2025-11-19 00:35:12 UTC FDB013778 (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one Constituent of Muscari comosum (tassel hyacinth). (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one is found in herbs and spices. C29H46O4 458.6731 458.33960996 1-[5'-hydroxy-6'-(hydroxymethyl)-2',3,6',11',15'-pentamethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan]-1'(10')-en-5-yl]propan-1-one 1-[5'-hydroxy-6'-(hydroxymethyl)-2',3,6',11',15'-pentamethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan]-1'(10')-en-5-yl]propan-1-one CCC(=O)C1CC(C)C2(CCC3(C)C4=C(CCC23C)C2(C)CCC(O)C(C)(CO)C2CC4)O1 InChI=1S/C29H46O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-24,30,32H,7-17H2,1-6H3 WKRCCXBCFBIWPN-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 heteropolycyclic compounds 3-hydroxysteroids Cyclic alcohols and derivatives Dialkyl ethers Hydrocarbon derivatives Ketones Organic oxides Oxacyclic compounds Primary alcohols Secondary alcohols Tetrahydrofurans 3-hydroxysteroid Alcohol Aliphatic heteropolycyclic compound Carbonyl group Cyclic alcohol Dialkyl ether Ether Hydrocarbon derivative Hydroxysteroid Ketone Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Primary alcohol Secondary alcohol Steroid Tetrahydrofuran Triterpenoid logp 4.95 ALOGPS logs -4.99 ALOGPS solubility 4.73e-03 g/l ALOGPS melting_point Mp 195-197° logp 4.57 ChemAxon pka_strongest_acidic 14.48 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 1-[5'-hydroxy-6'-(hydroxymethyl)-2',3,6',11',15'-pentamethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan]-1'(10')-en-5-yl]propan-1-one ChemAxon average_mass 458.6731 ChemAxon mono_mass 458.33960996 ChemAxon smiles CCC(=O)C1CC(C)C2(CCC3(C)C4=C(CCC23C)C2(C)CCC(O)C(C)(CO)C2CC4)O1 ChemAxon formula C29H46O4 ChemAxon inchi InChI=1S/C29H46O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-24,30,32H,7-17H2,1-6H3 ChemAxon inchikey WKRCCXBCFBIWPN-UHFFFAOYSA-N ChemAxon polar_surface_area 66.76 ChemAxon refractivity 131 ChemAxon polarizability 54.68 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19765 Specdb::CMs 44217 Specdb::CMs 155669 Specdb::MsMs 103521 Specdb::MsMs 103522 Specdb::MsMs 103523 Specdb::MsMs 169578 Specdb::MsMs 169579 Specdb::MsMs 169580 Specdb::MsMs 3046378 Specdb::MsMs 3046379 Specdb::MsMs 3046380 Specdb::MsMs 3094162 Specdb::MsMs 3094163 Specdb::MsMs 3094164 HMDB35142 #<Reference:0x000055ce32d31818> Herbs and Spices Unknown generic