4beta,5-Epoxy-17beta-hydroxy-5beta-androstan-3-one
(1S,2R,6R,8R,11S,12S,15S,16S)-15-hydroxy-2,16-dimethyl-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadecan-5-one
Also Known As: 4beta,5beta-Epoxytestosterone|KST-1A3124|4beta,5-Epoxy-17beta-hydroxy-5beta-androstan-3-one|(4|A,5|A,17|A)-17-hydroxy-4,5-epoxyandrostan-3-one|17beta-Hydroxy-4beta,5-epoxy-5beta-androstane-3-one|17beta-Hydroxy-4beta,5beta-4,5-epoxyandrostan-3-one|17beta-Hydroxy-4beta,5beta-epoxy-5beta-androstan-3-one|(4I(2),5I(2),17I(2))-4,5-Epoxy-17-hydroxyandrostan-3-one|(1S,2R,6R,8R,11S,12S,15S,16S)-15-hydroxy-2,16-dimethyl-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadecan-5-one
| Molecular Formula | C19H28O3 |
|---|---|
| Molecular Weight | 304.20386 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.20386 |
| Monoisotopic Mass | 304.20386 |
| Heavy Atoms | 22 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 2189-83-5 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@]45[C@@]3(CCC(=O)[C@@H]4O5)C |
| InChIKey | FNRMBSNOUHBOND-CTPLVLMWSA-N |
Product Overview
4beta,5-Epoxy-17beta-hydroxy-5beta-androstan-3-one (CAS 2189-83-5), with molecular formula C19H28O3 and molecular weight 304.20386 g/mol. IUPAC: (1S,2R,6R,8R,11S,12S,15S,16S)-15-hydroxy-2,16-dimethyl-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadecan-5-one.