Androstenediol 3-acetate 17-benzoate

[(3S,8R,9S,10R,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] benzoate

Also Known As: androstenediol 3-acetate 17-benzoate|EINECS 227-717-3|Androstenediol 3-acetate-17-benzoate|SKF 2895|SKF-2895|ANDROSTENEDIOL-3-ACETATE-17-BENZOATE|EM-1397|Androst-5-ene-3beta,17beta-diol 3-acetate 17-benzoate|ANDROSTENEDIOL 3-ACETATE-17-BENZOATE [MI]|Androst-5-ene-(3beta,17beta)-diol 3-acetate 17-benzoate|Androst-5-ene-3.beta.,17.beta.-diol, 3-acetate benzoate|Androst-5-ene-3,17-diol, 3-acetate 17-benzoate, (3.beta.,17.beta.)-|(3S,8R,9S,10R,13S,14S,17S)-3-acetoxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl benzoate|(1S,3aS,3bR,7S,9aR,9bS,11aS)-7-(acetyloxy)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl benzoate|[(3S,8R,9S,10R,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] benzoate|Androst-5-ene-3,17-diol, 3-acetate 17-benzoate, (3ss,17ss)-; Androst-5-ene-3ss,17ss-diol, 3-acetate 17-benzoate (6CI,7CI); Androst-5-ene-3ss,17ss-diol, 3-acetate benzoate (8CI); Androstenediol 3-acetate 17-benzoate; EM 1397; NSC 148900; SKF 2895

Molecular Formula	C28H36O4
Molecular Weight	436.26135 g/mol
LogP	6.1065
Topological Polar Surface Area	52.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	436.26135
Monoisotopic Mass	436.26135
Heavy Atoms	32
Complexity	920.6199

Chemical Identifiers

CAS Number	5953-63-9
SMILES	CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4OC(=O)C5=CC=CC=C5)C)C