[3-acetyloxy-11-(5-chloranylpentyl)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] ethanoate

Systemtic Name: [3-acetyloxy-11-(5-chloranylpentyl)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] ethanoate Openeye Name: [3-acetoxy-11-(5-chloropentyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] acetate CAS Name: acetic acid [3-acetyloxy-11-(5-chloropentyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] ester IUPAC Name: [3-acetyloxy-11-(5-chloropentyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] acetate Traditional Name: acetic acid [3-acetoxy-11-(5-chloropentyl)-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] ester Formula: C27H35ClO5 MolecularWeight: 475.0168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2C3CCC4=C(C3C(CC2(C1=O)C)CCCCCCl)C=CC(=C4)OC(=O)C

Isomeric SMILES

CC(=O)OC1CC2C3CCC4=C(C3C(CC2(C1=O)C)CCCCCCl)C=CC(=C4)OC(=O)C

InChI

InChI=1S/C27H35ClO5/c1-16(29)32-20-9-11-21-18(13-20)8-10-22-23-14-24(33-17(2)30)26(31)27(23,3)15-19(25(21)22)7-5-4-6-12-28/h9,11,13,19,22-25H,4-8,10,12,14-15H2,1-3H3