Doxibetasol
(8S,9R,10S,11S,13S,14S,16S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C22H29FO4 |
|---|---|
| Molecular Weight | 376.5 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.6 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 376.205 |
| Heavy Atoms | 27 |
| Complexity | 787.0 |
Chemical Identifiers
| CAS Number | 1879-77-2 |
|---|---|
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)C)O)C)O)F)C |
| InChIKey | IKGBPSZWCRRUQS-DTAAKRQUSA-N |
📖 Product Overview
Doxibetasol (CAS: 1879-77-2) is a chemical compound with molecular formula C22H29FO4 and molecular weight 376.5 g/mol. Its IUPAC systematic name is (8S,9R,10S,11S,13S,14S,16S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one.
IKGBPSZWCRRUQS-DTAAKRQUSA-N.
SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)C)O)C)O)F)C.
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