Basic information
- CAS
51262-24-9- Standard SMILES
CC[C@]12CCc3c(ccc4cc(O)ccc34)[C@H]1CCC2=O- InChIKey
YZJAQTXHBYIUOK-MJGOQNOKSA-N- Molecular formula
- C19H20O2
- Average molar mass
- 280.4 g/mol
Names & identifiers
- Preferred name
- Gona-1,3,5,7,9-pentaen-17-one, 13-ethyl-3-hydroxy-, (14beta)-
- IUPAC
- (13S,14R)-13-ethyl-3-hydroxy-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
- English name
- (14β)-13-Ethyl-3-hydroxy-1,3,5,7,9-gonapenten-17-one
- Molecular formula
- C19H20O2
- Molecular weight
- 280.36
Names & synonyms
YZJAQTXHBYIUOK-MJGOQNOKSA-NGona-1,3,5,7,9-pentaen-17-one, 13-ethyl-3-hydroxy-, (14.beta.)-(14β)-13-Ethyl-3-hydroxy-1,3,5,7,9-gonapenten-17-oneGona-1,3,5,7,9-pentaen-17-one, 13-ethyl-3-hydroxy-, (14β)-
Database identifiers
- CAS
51262-24-9- Nikkaji
- J143.356C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 431
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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