19-Tetrahydropyranyloxy-1,4-androstadiene-3,17-dione
Basic information
- Standard SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43COC3CCCCO3)[C@@H]1CCC2=O- InChIKey
GVPMPKLSWNFRAW-BTQIHSFSSA-N- Molecular formula
- C24H32O4
- Average molar mass
- 384.5 g/mol
- Monoisotopic mass
- 384.2300595
Names & identifiers
- Preferred name
- 19-Tetrahydropyranyloxy-1,4-androstadiene-3,17-dione
- IUPAC
- (8R,9S,10S,13S,14S)-13-methyl-10-(oxan-2-yloxymethyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
Names & synonyms
SCHEMBL11532897GVPMPKLSWNFRAW-BTQIHSFSSA-N19-tetrahydropyranyloxy-1,4-androstadiene-3,17-dione
Database identifiers
- PubChem CID
- 22806901
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 737
Related reactions
1 records
Compound notes
Loading…