Cholesteryl crotonate

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] but-2-enoate

Also Known As: cholesteryl crotonate|Cholest-5-en-3beta-yl crotonate|Cholest-5-en-3beta-yl but-2-enoate|[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-but-2-enoate

Molecular Formula	C31H50O2
Molecular Weight	454.38107 g/mol
LogP	8.52
Topological Polar Surface Area	26.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	7
Exact Mass	454.38107
Heavy Atoms	33
Complexity	762.9

Chemical Identifiers

CAS Number	24951-77-7
SMILES	CC=CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C