[(13S,14S,17S)-17-acetyloxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl ethanoate

Systemtic Name: [(13S,14S,17S)-17-acetyloxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl ethanoate Openeye Name: [(13S,14S,17S)-17-acetoxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl acetate CAS Name: acetic acid [(13S,14S,17S)-17-acetyloxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl ester IUPAC Name: [(13S,14S,17S)-17-acetyloxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl acetate Traditional Name: acetic acid [(13S,14S,17S)-17-acetoxy-3-methoxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-4-yl]methyl ester Formula: C24H28O5 MolecularWeight: 396.47612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C=CC2=C1C=CC3=C2CCC4(C3CCC4OC(=O)C)C)OC

Isomeric SMILES

CC(=O)OCC1=C(C=CC2=C1C=CC3=C2CC[C@]4([C@H]3CC[C@@H]4OC(=O)C)C)OC

InChI

InChI=1S/C24H28O5/c1-14(25)28-13-20-17-5-6-19-18(16(17)7-9-22(20)27-4)11-12-24(3)21(19)8-10-23(24)29-15(2)26/h5-7,9,21,23H,8,10-13H2,1-4H3/t21-,23-,24-/m0/s1