Epicoprostanol
(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Epicoprostanol|epi-Coprostanol|Epicoprosterol|Epikoprosterin|epi-Coprosterol|5beta-Cholestan-3alpha-ol|.alpha.-Coprostanol|alpha-Coprostanol|Dihydrocholesterol|5b-cholestan-3a-ol|5-Cholestan-3-ol|Coprostan-3.alpha.-ol|Cholestan-3-ol, (3a,5b)-|(3alpha,5beta)-cholestan-3-ol|5betaCholestan-3alpha-ol|A-Cholestan-3|A-ol|Cholestan-3-ol,5.beta.)-|5.beta.-Cholestan-3.alpha.-ol|5.BETA.-EPICHOLESTANOL|3alpha-Hydroxy-5beta-cholestane|EPICOPROSTANOL [USP-RS]|Cholestan-3-ol, (3alpha,5beta)-|3-alpha-hydroxy-5beta-cholestanol|Cholestan-3-ol, (3|A,5|A)-|Tox21_112538|NCGC00167541-01
| Molecular Formula | C27H48O |
|---|---|
| Molecular Weight | 388.3705 g/mol |
| LogP | 7.47 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.3705 |
| Heavy Atoms | 28 |
| Complexity | 540.4 |
Chemical Identifiers
| CAS Number | 516-92-7 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C |
Product Overview
Epicoprostanol (CAS 516-92-7), with molecular formula C27H48O and molecular weight 388.3705 g/mol. IUPAC: (3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol.
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