[(11R,13S,17R)-17-(2-methoxyethanoyl)-13-methyl-3-oxidanylidene-11-(4-piperidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] ethanoate

Systemtic Name: [(11R,13S,17R)-17-(2-methoxyethanoyl)-13-methyl-3-oxidanylidene-11-(4-piperidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] ethanoate Openeye Name: [(11R,13S,17R)-17-(2-methoxyacetyl)-13-methyl-3-oxo-11-[4-(1-piperidyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate CAS Name: acetic acid [(11R,13S,17R)-17-(2-methoxy-1-oxoethyl)-13-methyl-3-oxo-11-[4-(1-piperidinyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [(11R,13S,17R)-17-(2-methoxyacetyl)-13-methyl-3-oxo-11-(4-piperidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate Traditional Name: acetic acid [(11R,13S,17R)-3-keto-17-(2-methoxyacetyl)-13-methyl-11-(4-piperidinophenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] ester Formula: C34H43NO5 MolecularWeight: 545.70892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

Isomeric SMILES

CC(=O)O[C@@]1(CCC2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

InChI

InChI=1S/C34H43NO5/c1-22(36)40-34(31(38)21-39-3)16-15-30-28-13-9-24-19-26(37)12-14-27(24)32(28)29(20-33(30,34)2)23-7-10-25(11-8-23)35-17-5-4-6-18-35/h7-8,10-11,19,28-30H,4-6,9,12-18,20-21H2,1-3H3/t28?,29-,30?,33+,34+/m1/s1