(13S,14S)-13-methyl-3-oxidanyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one

Systemtic Name: (13S,14S)-13-methyl-3-oxidanyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one Openeye Name: (13S,14S)-3-hydroxy-13-methyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one CAS Name: (13S,14S)-3-hydroxy-13-methyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one IUPAC Name: (13S,14S)-3-hydroxy-13-methyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one Traditional Name: (13S,14S)-3-hydroxy-13-methyl-15,16-dihydro-14H-cyclopenta[a]phenanthren-17-one Formula: C18H16O2 MolecularWeight: 264.31844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12C=CC3=C(C1CCC2=O)C=CC4=C3C=CC(=C4)O

Isomeric SMILES

C[C@]12C=CC3=C([C@@H]1CCC2=O)C=CC4=C3C=CC(=C4)O

InChI

InChI=1S/C18H16O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,8-10,16,19H,6-7H2,1H3/t16-,18-/m0/s1