1.0 2010-04-08 22:04:56 UTC 2025-11-18 22:30:52 UTC FDB001375 Australigenin Sapogenin from Cordyline australis (cabbage tree). Australigenin is found in alcoholic beverages and beverages. Australigenin C27H42O4 430.62 430.308309832 7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-14',16'-diol 7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-14',16'-diol 90865-22-8 CC1C2C(CC3C4CCC5CC(O)CC(O)C5(C)C4CCC23C)OC11CCC(=C)CO1 InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h16-24,28-29H,1,5-14H2,2-4H3 XLHFBXMTUNORSV-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 1-hydroxysteroids 3-hydroxysteroids Cyclic alcohols and derivatives Hydrocarbon derivatives Ketals Oxacyclic compounds Oxanes Secondary alcohols Spirostanes and derivatives Tetrahydrofurans 1-hydroxysteroid 3-hydroxysteroid Acetal Alcohol Aliphatic heteropolycyclic compound Cyclic alcohol Hydrocarbon derivative Hydroxysteroid Ketal Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Secondary alcohol Spirostane skeleton Steroid Tetrahydrofuran Triterpenoid logp 2.63 ALOGPS logs -5.03 ALOGPS solubility 4.03e-03 g/l ALOGPS logp 3.76 ChemAxon pka_strongest_acidic 14.5 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac 7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-14',16'-diol ChemAxon average_mass 430.62 ChemAxon mono_mass 430.308309832 ChemAxon smiles CC1C2C(CC3C4CCC5CC(O)CC(O)C5(C)C4CCC23C)OC11CCC(=C)CO1 ChemAxon formula C27H42O4 ChemAxon inchi InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h16-24,28-29H,1,5-14H2,2-4H3 ChemAxon inchikey XLHFBXMTUNORSV-UHFFFAOYSA-N ChemAxon polar_surface_area 58.92 ChemAxon refractivity 120.59 ChemAxon polarizability 50.29 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10663 Specdb::CMs 41725 Specdb::CMs 168646 Specdb::MsMs 8651 Specdb::MsMs 8652 Specdb::MsMs 8653 Specdb::MsMs 15323 Specdb::MsMs 15324 Specdb::MsMs 15325 Specdb::MsMs 2347382 Specdb::MsMs 2347383 Specdb::MsMs 2347384 Specdb::MsMs 2592187 Specdb::MsMs 2592188 Specdb::MsMs 2592189 HMDB0030066 Alcoholic beverages Unknown generic Beverages Unknown generic