7-Dehydrocholesterol benzoate

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

Also Known As: 7-Dehydrocholesterol benzoate|7-Dehydrocholesteryl benzoate|5, benzoate|Cholesta-5, benzoate|delta5,7-Cholesteryl benzoate|Cholesta-5,7-dien-3beta-ol benzoate|.DELTA.5,7-Cholesteryl benzoate|3beta-Benzoyloxycholesta-5,7-diene|Delta(5,7)-cholesteryl benzoate|cholesta-5,7-dien-3beta-yl benzoate|5,7-Cholestandien-3beta-ol, benzoate|EINECS 214-653-6|3.beta.-Benzoyloxycholesta-5,7-diene|3b-benzoyloxycholesta-5,7-diene|Cholesta-5,7-dien-3-ol, benzoate, (3.beta.)-|A-benzoyloxycholesta-5,7-diene|Cholesta-5,7-dien-3.beta.-ol, benzoate|Cholesta-5,7-dien-3-beta-yl benzoate|Cholesta-5,7-dien-3beta-ol, benzoate|cholesta-5,7-dien-3|A-ol benzoate|5,7-Cholestandien-3.beta.-ol, benzoate|Cholesta-5, benzoate, (3.beta.)-|Cholesta-5,7-dien-3-yl benzoate #|3B-Chonest-5,7-dien-3-ola benzoate|Cholesta-5,7-diene-3beta-ol benzoate|Cholesta-5,7-dien-3-ol, benzoate, (3beta)-|Cholesta-5,7-dien-3.beta.-ol benzoate|Cholesta-5,7-dien-3beta-ol 3-benzoate

Molecular Formula	C34H48O2
Molecular Weight	488.36542 g/mol
LogP	9.17
Topological Polar Surface Area	26.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	7
Exact Mass	488.36542
Heavy Atoms	36
Complexity	1003.3

Chemical Identifiers

CAS Number	1182-06-5
SMILES	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C5=CC=CC=C5)C)C