11,21-Dihydroxy-6-methylpregna-4,17-dien-3-one
(6S,8S,9S,10R,11S,13S,14S)-11-hydroxy-17-(2-hydroxyethylidene)-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 11,21-Dihydroxy-6-methylpregna-4,17-dien-3-one|11beta,21-Dihydroxy-6alpha-methylpregna-4,17-dien-3-one|(6S,8S,9S,10R,11S,13S,14S)-11-hydroxy-17-(2-hydroxyethylidene)-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
| Molecular Formula | C22H32O3 |
|---|---|
| Molecular Weight | 344.23514 g/mol |
| LogP | 3.65 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.23514 |
| Heavy Atoms | 25 |
| Complexity | 647.7 |
Chemical Identifiers
| CAS Number | 3386-04-7 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CCC(=CCO)[C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)CC4)C)O)C |
Product Overview
11,21-Dihydroxy-6-methylpregna-4,17-dien-3-one (CAS 3386-04-7), with molecular formula C22H32O3 and molecular weight 344.23514 g/mol. IUPAC: (6S,8S,9S,10R,11S,13S,14S)-11-hydroxy-17-(2-hydroxyethylidene)-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
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