7-Oxocholesteryl acetate

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

Also Known As: 7-Oxocholesteryl acetate|7-Oxocholesterol acetate|7-Oxo Cholesterol 3-Acetate|7-Ketocholesteryl Acetate|7-KETOCHOLESTEROL ACETATE|7-Oxocholest-5-en-3-beta-yl acetate|Cholest-5-en-7-one, acetate|3beta-acetoxy-cholest-5-en-7-one|EINECS 212-368-1|ERK5-5D11|3beta-Acetoxy-5-cholesten-7-one|3beta-Acetoxycholest-5-en-7-one|3I(2)-Acetoxycholest-5-en-7-one|(3beta)-3-(Acetyloxy)cholest-5-en-7-one|6780AF|7-Oxocholest-5-en-3-yl acetate #|7-Oxocholest-5-en-3beta-ol acetate|7-Oxocholest-5-en-3beta-yl acetate|Cholest-5-en-7-one, (3.beta.)-|3beta-(Acetyloxy)cholest-5-en-7-one|FS-7324|(3)-3-(Acetyloxy)cholest-5-en-7-one|3?-Hydroxy-cholest-5-en-7-one acetate|5-Cholesten-3.beta.-ol-7-one, acetate|(3?)-3-(Acetyloxy)cholest-5-en-7-one|Acetic acid 7-oxo-3beta-cholesteryl ester|(3|A)-3-(Acetyloxy)cholest-5-en-7-one|Cholest-5-en-7-one, 3.beta.-hydroxy-, acetate

Molecular Formula	C29H46O3
Molecular Weight	442.3447 g/mol
LogP	7.14
Topological Polar Surface Area	43.37 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	442.3447
Heavy Atoms	32
Complexity	766.4

Chemical Identifiers

CAS Number	809-51-8
SMILES	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C