(8R,9S,13S,14S,16Z)-13-methyl-3-oxidanyl-16-[(4-propan-2-ylphenyl)methylidene]-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one

Systemtic Name: (8R,9S,13S,14S,16Z)-13-methyl-3-oxidanyl-16-[(4-propan-2-ylphenyl)methylidene]-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one Openeye Name: (8R,9S,13S,14S,16Z)-3-hydroxy-16-[(4-isopropylphenyl)methylene]-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one CAS Name: (8R,9S,13S,14S,16Z)-3-hydroxy-13-methyl-16-[(4-propan-2-ylphenyl)methylidene]-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one IUPAC Name: (8R,9S,13S,14S,16Z)-3-hydroxy-13-methyl-16-[(4-propan-2-ylphenyl)methylidene]-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one Traditional Name: (8R,9S,13S,14S,16Z)-3-hydroxy-16-(4-isopropylbenzylidene)-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one Formula: C28H32O2 MolecularWeight: 400.55248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C2CC3C4CCC5=C(C4CCC3(C2=O)C)C=CC(=C5)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C\2/C[C@H]3[C@@H]4CCC5=C([C@H]4CC[C@@]3(C2=O)C)C=CC(=C5)O

InChI

InChI=1S/C28H32O2/c1-17(2)19-6-4-18(5-7-19)14-21-16-26-25-10-8-20-15-22(29)9-11-23(20)24(25)12-13-28(26,3)27(21)30/h4-7,9,11,14-15,17,24-26,29H,8,10,12-13,16H2,1-3H3/b21-14-/t24-,25-,26+,28+/m1/s1