17-ethanoyl-13-methyl-17-(3-oxidanylprop-1-ynyl)-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 17-ethanoyl-13-methyl-17-(3-oxidanylprop-1-ynyl)-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Openeye Name: 17-acetyl-17-(3-hydroxyprop-1-ynyl)-13-methyl-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one CAS Name: 17-acetyl-17-(3-hydroxyprop-1-ynyl)-13-methyl-11-[4-(1-pyrrolidinyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 17-acetyl-17-(3-hydroxyprop-1-ynyl)-13-methyl-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Traditional Name: 17-acetyl-17-(3-hydroxyprop-1-ynyl)-13-methyl-11-(4-pyrrolidinophenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Formula: C33H39NO3 MolecularWeight: 497.66766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCC6)C)C#CCO

Isomeric SMILES

CC(=O)C1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCC6)C)C#CCO

InChI

InChI=1S/C33H39NO3/c1-22(36)33(15-5-19-35)16-14-30-28-12-8-24-20-26(37)11-13-27(24)31(28)29(21-32(30,33)2)23-6-9-25(10-7-23)34-17-3-4-18-34/h6-7,9-10,20,28-30,35H,3-4,8,11-14,16-19,21H2,1-2H3