Basic information
- Standard SMILES
C[C@]12CC[C@H]3[C@@H](CCC4[C@H](F)C(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O- InChIKey
WNCGBUVDBDKDRF-CGFCEBBTSA-N- Molecular formula
- C19H29FO2
- Average molar mass
- 308.4 g/mol
Names & identifiers
- Preferred name
- 4alpha-Fluoro-17beta-hydroxyandrostan-3-one
- IUPAC
- (4S,8R,9S,10R,13S,14S,17S)-4-fluoro-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Names & synonyms
SCHEMBL3652868WNCGBUVDBDKDRF-CGFCEBBTSA-N4alpha-fluoro-17beta-hydroxyandrostan-3-one
Database identifiers
- PubChem CID
- 68730165
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 492
Related reactions
1 records
Compound notes
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