Icometasone enbutate
[(8S,9R,10S,11S,13S,14S,16R,17R)-17-(2-acetyloxyacetyl)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate
| Molecular Formula | C28H37ClO7 |
|---|---|
| Molecular Weight | 521.0 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 107.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 520.2228 |
| Heavy Atoms | 36 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 103466-73-5 |
|---|---|
| SMILES | CCCC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)C(=O)COC(=O)C |
| InChIKey | OVTRPNSKIPQZEC-NJLPOHDGSA-N |
📖 Product Overview
Icometasone enbutate (CAS: 103466-73-5) is a chemical compound with molecular formula C28H37ClO7 and molecular weight 521.0 g/mol. Its IUPAC systematic name is [(8S,9R,10S,11S,13S,14S,16R,17R)-17-(2-acetyloxyacetyl)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate.
OVTRPNSKIPQZEC-NJLPOHDGSA-N.
SMILES: CCCC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)C(=O)COC(=O)C.
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