Basic information
- Standard SMILES
CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O[Si](C)(C)C)C[C@]12C- InChIKey
IYVVBTOYZTZYNI-YZDXUCJSSA-N- Molecular formula
- C26H37FO5Si
- Average molar mass
- 476.7 g/mol
Names & identifiers
- Preferred name
- 11beta-Trimethylsiloxy-21-acetoxy-6alpha-fluoropregna-4,16-diene-3,20-dione
- IUPAC
- [2-[(6S,8S,9S,10R,11S,13S,14S)-6-fluoro-10,13-dimethyl-3-oxo-11-trimethylsilyloxy-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Names & synonyms
SCHEMBL11706045IYVVBTOYZTZYNI-YZDXUCJSSA-N11beta-trimethylsiloxy-21-acetoxy-6alpha-fluoropregna-4,16-diene-3,20-dione
Database identifiers
- PubChem CID
- 22798532
Properties
Computed structural properties
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 933
Related reactions
1 records
Compound notes
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