11alpha,17beta-Dihydroxyestr-4-en-3-one
(8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: KST-1A3072|A)-11,17-dihydroxyestr-4-en-3-one|A,17|(11|A,17|A)-11,17-dihydroxyestr-4-en-3-one|11alpha,17beta-Dihydroxyestr-4-en-3-one|(8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
| Molecular Formula | C18H26O3 |
|---|---|
| Molecular Weight | 290.1882 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 290.1882 |
| Monoisotopic Mass | 290.1882 |
| Heavy Atoms | 21 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 2133-53-1 |
|---|---|
| SMILES | C[C@]12C[C@H]([C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@H]34)O |
| InChIKey | DZMDSUHTQULTAH-TTYRWSMDSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
11alpha,17beta-Dihydroxyestr-4-en-3-one (CAS 2133-53-1), with molecular formula C18H26O3 and molecular weight 290.1882 g/mol. IUPAC: (8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one.
11alpha,17beta-Dihydroxyestr-4-en-3-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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