Roxibolone
(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13,17-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2-carboxylic acid
| Molecular Formula | C21H28O5 |
|---|---|
| Molecular Weight | 360.4 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 94.8 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.19366 |
| Heavy Atoms | 26 |
| Complexity | 752.0 |
Chemical Identifiers
| CAS Number | 60023-92-9 |
|---|---|
| SMILES | CC1(CCC2C1(CC(C3C2CCC4=CC(=O)C(=CC34C)C(=O)O)O)C)O |
| InChIKey | JOFBZBDWOWPUMO-QARKFJNLSA-N |
📖 Product Overview
Roxibolone (CAS: 60023-92-9) is a chemical compound with molecular formula C21H28O5 and molecular weight 360.4 g/mol. Its IUPAC systematic name is (8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13,17-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2-carboxylic acid.
JOFBZBDWOWPUMO-QARKFJNLSA-N.
SMILES: CC1(CCC2C1(CC(C3C2CCC4=CC(=O)C(=CC34C)C(=O)O)O)C)O.
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