4-Androstene-17,19-dione
Basic information
- Standard SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@@]43C=O)[C@@H]1CCC2=O- InChIKey
GQLNTJMNGYMPRV-BGJMDTOESA-N- Molecular formula
- C19H26O2
- Average molar mass
- 286.4 g/mol
Names & identifiers
- Preferred name
- 4-Androstene-17,19-dione
- IUPAC
- (8R,9S,10S,13S,14S)-13-methyl-17-oxo-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
Names & synonyms
4-androstene-17,19-dioneSCHEMBL11661855GQLNTJMNGYMPRV-BGJMDTOESA-N
Database identifiers
- PubChem CID
- 11087397
- Nikkaji
- J621.069D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 520
Related reactions
2 records
Compound notes
Loading…