Pregnenolone methyl ether

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

Also Known As: Pregnenolone methyl ether|MAP4343|Pregnenolone 3-methyl ether|3ss-MethoxyPREG|3-methoxy-pregnenolone|3beta-Methoxypregnenolone|Pregnenolone methyl ether [MI]|MAP-4343|3beta-Methoxy-5-pregnen-20-one|3beta-Methoxypregn-5-en-20-one|3.BETA.-METHOXYPREGNENOLONE|EX-A9306|pregn-5-en-20-one, 3|A-methoxy-|Pregn-5-en-20-one, (3.beta.)-|(3beta)-3-Methoxypregn-5-en-20-one|Pregn-5-en-20-one, 3.beta.-methoxy-|Pregn-5-en-20-one, 3-methoxy-, (3beta)-|3.BETA.-METHOXY-5-PREGNEN-20-ONE|L-542856-0|Pregn-5-en-20-one, 3-methoxy-, (3.beta.)-|1-[(3S,8S,9S,10R,13S,14S,17S)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone|L 542856-0|1-[(1S,3aS,3bS,7S,9aR,9bS,11aS)-7-methoxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethan-1-one|1-[(3S,8S,9S,10R,13R,14S,17S)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11, 12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone|1-[(3S,8S,9S,10R,13R,14S,17S)-3-METHOXY-10,13-DIMETHYL-2,3,4,7,8,9,11,12,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL]ETHANONE

Molecular Formula	C22H34O2
Molecular Weight	330.2559 g/mol
LogP	4.8
Topological Polar Surface Area	26.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	330.2559
Monoisotopic Mass	330.2559
Heavy Atoms	24
Complexity	564.0

Chemical Identifiers

CAS Number	54571-17-4
SMILES	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC)C)C
InChIKey	ZVGQOQHAMHMMNE-BIBIXIOVSA-N