17beta,19-Dihydroxy-17alpha-methyl-4-androsten-3-one
Basic information
- Standard SMILES
C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(CO)[C@H]3CC[C@@]21C- InChIKey
SUHARHYRKNETPJ-RPZLJYRGSA-N- Molecular formula
- C20H30O3
- Average molar mass
- 318.4 g/mol
Names & identifiers
- Preferred name
- 17beta,19-Dihydroxy-17alpha-methyl-4-androsten-3-one
- IUPAC
- (8R,9S,10S,13S,14S,17S)-17-hydroxy-10-(hydroxymethyl)-13,17-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Names & synonyms
SCHEMBL11423506SUHARHYRKNETPJ-RPZLJYRGSA-N17beta,19-dihydroxy-17alpha-methyl-4-androsten-3-one
Database identifiers
- PubChem CID
- 70583258
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 567
Related reactions
3 records
Compound notes
Loading…