[(3S,7S,10R,13S)-7-acetyloxy-10,13-dimethyl-spiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-yl] ethanoate

Systemtic Name: [(3S,7S,10R,13S)-7-acetyloxy-10,13-dimethyl-spiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-yl] ethanoate Openeye Name: [(3S,7S,10R,13S)-7-acetoxy-10,13-dimethyl-spiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-yl] acetate CAS Name: acetic acid [(3S,7S,10R,13S)-7-acetyloxy-10,13-dimethyl-3-spiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]yl] ester IUPAC Name: [(3S,7S,10R,13S)-7-acetyloxy-10,13-dimethylspiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-yl] acetate Traditional Name: acetic acid [(3S,7S,10R,13S)-7-acetoxy-10,13-dimethyl-spiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-yl] ester Formula: C25H36O6 MolecularWeight: 432.54974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC2(C3CCC4(C(C3C(C=C2C1)OC(=O)C)CCC45OCCO5)C)C

Isomeric SMILES

CC(=O)O[C@H]1CC[C@@]2(C3CC[C@]4(C(C3[C@@H](C=C2C1)OC(=O)C)CCC45OCCO5)C)C

InChI

InChI=1S/C25H36O6/c1-15(26)30-18-5-8-23(3)17(13-18)14-21(31-16(2)27)22-19(23)6-9-24(4)20(22)7-10-25(24)28-11-12-29-25/h14,18-22H,5-13H2,1-4H3/t18-,19?,20?,21+,22?,23-,24-/m0/s1