17-Hydroxy-7,17-dimethylandrostan-3-one
Basic information
- CAS
51067-45-9- Standard SMILES
CC1CC2CC(=O)CCC2(C)C2CCC3(C)C(CCC3(C)O)C12- InChIKey
OXGWMWXYFIDNLU-UHFFFAOYSA-N- Molecular formula
- C21H34O2
- Average molar mass
- 318.5 g/mol
- Monoisotopic mass
- 318.25588032
Names & identifiers
- Preferred name
- 17-Hydroxy-7,17-dimethylandrostan-3-one
- IUPAC
- 17-hydroxy-7,10,13,17-tetramethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Names & synonyms
51067-45-917-hydroxy-7,17-dimethylandrostan-3-oneNSC143924DTXSID90965351NSC-143924
Database identifiers
- CAS
51067-45-9- PubChem CID
- 286105
- DTXSID
DTXSID90965351
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 528
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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