AC1L5GZM
(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(2-fluoroacetyl)-11,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: progesterone, 9,21-difluoro-11|A,17-dihydroxy-|Progesterone,21-difluoro-11.beta.,17-dihydroxy-|Pregn-4-ene-3, 9,21-difluoro-11.beta.,17-dihydroxy-|(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(2-fluoroacetyl)-11,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one|Pregn-4-ene-3,20-dione (8CI), 9,21-difluoro-11.beta.,17-dihydro
| Molecular Formula | C21H28F2O4 |
|---|---|
| Molecular Weight | 382.19556 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.19556 |
| Monoisotopic Mass | 382.19556 |
| Heavy Atoms | 27 |
| Complexity | 736.0 |
Chemical Identifiers
| CAS Number | 472-24-2 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CF)O)C)O)F |
| InChIKey | HMQHDCRSYKWXAA-BULBTXNYSA-N |
Product Overview
AC1L5GZM (CAS 472-24-2), with molecular formula C21H28F2O4 and molecular weight 382.19556 g/mol. IUPAC: (8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(2-fluoroacetyl)-11,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.