13-methyl-17-oxidanyl-17-prop-1-ynyl-2-(4-pyridin-3-ylphenyl)-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 13-methyl-17-oxidanyl-17-prop-1-ynyl-2-(4-pyridin-3-ylphenyl)-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Openeye Name: 17-hydroxy-13-methyl-17-prop-1-ynyl-2-[4-(3-pyridyl)phenyl]-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one CAS Name: 17-hydroxy-13-methyl-17-prop-1-ynyl-2-[4-(3-pyridinyl)phenyl]-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 17-hydroxy-13-methyl-17-prop-1-ynyl-2-(4-pyridin-3-ylphenyl)-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: 17-hydroxy-13-methyl-17-prop-1-ynyl-2-[4-(3-pyridyl)phenyl]-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Formula: C32H35NO2 MolecularWeight: 465.6258

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1(CCC2C1(CCC3C2CCC4=CC(=O)C(CC34)C5=CC=C(C=C5)C6=CN=CC=C6)C)O

Isomeric SMILES

CC#CC1(CCC2C1(CCC3C2CCC4=CC(=O)C(CC34)C5=CC=C(C=C5)C6=CN=CC=C6)C)O

InChI

InChI=1S/C32H35NO2/c1-3-14-32(35)16-13-29-26-11-10-23-18-30(34)28(19-27(23)25(26)12-15-31(29,32)2)22-8-6-21(7-9-22)24-5-4-17-33-20-24/h4-9,17-18,20,25-29,35H,10-13,15-16,19H2,1-2H3