3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate
[(8R,9S,10R,13S,14S,17R)-17-acetyl-3-ethoxy-10,13-dimethyl-6-(trifluoromethyl)-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: EINECS 220-542-3|3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate|3-ethoxy-17-hydroxy-6- pregna-3,5-diene-20-oneacetate|3-ethoxy-20-oxo-6-(trifluoromethyl)pregna-3,5-dien-17-yl acetate|[(8R,9S,10R,13S,14S,17R)-17-acetyl-3-ethoxy-10,13-dimethyl-6-(trifluoromethyl)-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate|Acetic acid 3-ethoxy-20-oxo-6-(trifluoromethyl)pregna-3,5-dien-17-yl ester|(1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-7-ethoxy-9a,11a-dimethyl-5-(trifluoromethyl)-1H,2H,3H,3aH,3bH,4H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
| Molecular Formula | C26H35F3O4 |
|---|---|
| Molecular Weight | 468.24875 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.24875 |
| Heavy Atoms | 33 |
| Complexity | 919.0 |
Chemical Identifiers
| CAS Number | 2802-19-9 |
|---|---|
| SMILES | CCOC1=CC2=C(C[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]4([C@H]3CC[C@@]4(C(=O)C)OC(=O)C)C)C(F)(F)F |
Product Overview
3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate (CAS 2802-19-9), with molecular formula C26H35F3O4 and molecular weight 468.24875 g/mol. IUPAC: [(8R,9S,10R,13S,14S,17R)-17-acetyl-3-ethoxy-10,13-dimethyl-6-(trifluoromethyl)-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate.
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