10,13-dimethyl-17-[6-methyl-2,3-bis(oxidanyl)heptan-2-yl]-16-oxidanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 10,13-dimethyl-17-[6-methyl-2,3-bis(oxidanyl)heptan-2-yl]-16-oxidanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Openeye Name: 17-(1,2-dihydroxy-1,5-dimethyl-hexyl)-16-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one CAS Name: 17-(2,3-dihydroxy-6-methylheptan-2-yl)-16-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 17-(2,3-dihydroxy-6-methylheptan-2-yl)-16-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: 17-(1,2-dihydroxy-1,5-dimethyl-hexyl)-16-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Formula: C27H44O4 MolecularWeight: 432.63586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C)(C1C(CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)O)O)O

Isomeric SMILES

CC(C)CCC(C(C)(C1C(CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)O)O)O

InChI

InChI=1S/C27H44O4/c1-16(2)6-9-23(30)27(5,31)24-22(29)15-21-19-8-7-17-14-18(28)10-12-25(17,3)20(19)11-13-26(21,24)4/h14,16,19-24,29-31H,6-13,15H2,1-5H3