Pregn-4-ene-3,20-dione, 6-beta-fluoro-16-alpha-methyl-
(6R,8S,9S,10R,13S,14S,16R,17S)-17-acetyl-6-fluoro-10,13,16-trimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 6-beta-Fluoro-16-alpha-methylprogesterone|Pregn-4-ene-3,20-dione, 6-beta-fluoro-16-alpha-methyl-|6-beta-Fluoro-16-alpha-methylpregn-4-ene-3,20-dione|6beta-Fluoro-16alpha-methylpregn-4-ene-3,20-dione|(1S,2R,3aS,3bS,5R,9aR,9bS,11aS)-1-acetyl-5-fluoro-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one|(6R,8S,9S,10R,13S,14S,16R,17S)-17-acetyl-6-fluoro-10,13,16-trimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C22H31FO2 |
|---|---|
| Molecular Weight | 346.2308 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.2308 |
| Monoisotopic Mass | 346.2308 |
| Heavy Atoms | 25 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 2133-49-5 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3C[C@H](C4=CC(=O)CC[C@@]4([C@H]3CC[C@@]2([C@H]1C(=O)C)C)C)F |
| InChIKey | OFMUOMXAKXABEF-LLKMXCJQSA-N |
Product Overview
Pregn-4-ene-3,20-dione, 6-beta-fluoro-16-alpha-methyl- (CAS 2133-49-5), with molecular formula C22H31FO2 and molecular weight 346.2308 g/mol. IUPAC: (6R,8S,9S,10R,13S,14S,16R,17S)-17-acetyl-6-fluoro-10,13,16-trimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.