(5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione

Systemtic Name: (5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione Openeye Name: (5S,8S,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione CAS Name: (5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione IUPAC Name: (5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione Traditional Name: (5S,8S,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-5,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,4,6-trione Formula: C27H40O3 MolecularWeight: 412.6047

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)C4C3(C(=O)C=CC4=O)C)C

Isomeric SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@]3(C(=O)C=CC4=O)C)C

InChI

InChI=1S/C27H40O3/c1-16(2)7-6-8-17(3)19-9-10-20-18-15-23(29)25-22(28)11-12-24(30)27(25,5)21(18)13-14-26(19,20)4/h11-12,16-21,25H,6-10,13-15H2,1-5H3/t17-,18+,19-,20+,21+,25-,26-,27-/m1/s1