(8xi,9xi,10xi,13xi,14xi,17xi,20xi)-6-Oxo-5alpha-cholestan-3beta-yl acetate
[(3S,5S)-10,13-dimethyl-17-(6-methylheptan-2-yl)-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 6-Oxocholestan-3-yl acetate, (8xi,9xi,10xi,13xi,14xi,17xi,20xi)-6-Oxo-5alpha-cholestan-3beta-yl acetate, [(3S,5S)-10,13-dimethyl-17-(6-methylheptan-2-yl)-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C29H48O3 |
|---|---|
| Molecular Weight | 444.36035 g/mol |
| LogP | 7.22 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.36035 |
| Heavy Atoms | 32 |
| Complexity | 713 |
Chemical Identifiers
| CAS Number | 1256-83-3 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)[C@@H]4C3(CC[C@@H](C4)OC(=O)C)C)C |
Product Overview
(8xi,9xi,10xi,13xi,14xi,17xi,20xi)-6-Oxo-5alpha-cholestan-3beta-yl acetate (CAS 1256-83-3), with molecular formula C29H48O3 and molecular weight 444.36035 g/mol. IUPAC: [(3S,5S)-10,13-dimethyl-17-(6-methylheptan-2-yl)-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate.
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