11beta,21-Dihydroxypregna-4,17-dien-3-one
(8S,9S,10R,11S,13S,14S)-11-hydroxy-17-(2-hydroxyethylidene)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 11beta,21-Dihydroxypregna-4,17-dien-3-one|11-beta,21-dihydroxypregna-4,17 -dien-3-one|11beta,21-dihydroxypregna-4,17(20)-dien-3-one|(11I(2))-11,21-Dihydroxypregna-4,17(20)-dien-3-one
| Molecular Formula | C21H30O3 |
|---|---|
| Molecular Weight | 330.21948 g/mol |
| LogP | 3.41 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.21948 |
| Heavy Atoms | 24 |
| Complexity | 618.6 |
Chemical Identifiers
| CAS Number | 3494-53-9 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=CCO)C)O |
Product Overview
11beta,21-Dihydroxypregna-4,17-dien-3-one (CAS 3494-53-9), with molecular formula C21H30O3 and molecular weight 330.21948 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S)-11-hydroxy-17-(2-hydroxyethylidene)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
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