[(5'S,11'R,13'S,17'R)-11'-(4-dimethylaminophenyl)-17'-ethanoyl-5',13'-dimethyl-spiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-yl] ethanoate

Systemtic Name: [(5'S,11'R,13'S,17'R)-11'-(4-dimethylaminophenyl)-17'-ethanoyl-5',13'-dimethyl-spiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-yl] ethanoate Openeye Name: [(5'S,11'R,13'S,17'R)-17'-acetyl-11'-(4-dimethylaminophenyl)-5',13'-dimethyl-spiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-yl] acetate CAS Name: acetic acid [(5'S,11'R,13'S,17'R)-17'-acetyl-11'-(4-dimethylaminophenyl)-5',13'-dimethyl-17'-spiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]yl] ester IUPAC Name: [(5'S,11'R,13'S,17'R)-17'-acetyl-11'-(4-dimethylaminophenyl)-5',13'-dimethylspiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-yl] acetate Traditional Name: acetic acid [(5'S,11'R,13'S,17'R)-17'-acetyl-11'-(4-dimethylaminophenyl)-5',13'-dimethyl-spiro[1,3-dioxolane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-yl] ester Formula: C33H45NO5 MolecularWeight: 535.7141

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCC2C1(CC(C3=C4CCC5(CC4(CCC23)C)OCCO5)C6=CC=C(C=C6)N(C)C)C)OC(=O)C

Isomeric SMILES

CC(=O)[C@]1(CCC2[C@@]1(C[C@@H](C3=C4CCC5(C[C@@]4(CCC23)C)OCCO5)C6=CC=C(C=C6)N(C)C)C)OC(=O)C

InChI

InChI=1S/C33H45NO5/c1-21(35)33(39-22(2)36)16-13-27-25-11-14-30(3)20-32(37-17-18-38-32)15-12-28(30)29(25)26(19-31(27,33)4)23-7-9-24(10-8-23)34(5)6/h7-10,25-27H,11-20H2,1-6H3/t25?,26-,27?,30+,31+,33+/m1/s1