Dexamethasone 21-iodoacetate
[2-[(8S,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-iodoacetate
| Molecular Formula | C24H30FIO6 |
|---|---|
| Molecular Weight | 560.4 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 101.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 560.1071 |
| Heavy Atoms | 32 |
| Complexity | 931.0 |
Chemical Identifiers
| CAS Number | 1893-66-9 |
|---|---|
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)CI)O)C)O)F)C |
| InChIKey | SBWPMXHFJJCNJZ-OWWZPINESA-N |
📖 Product Overview
Dexamethasone 21-iodoacetate (CAS: 1893-66-9) is a chemical compound with molecular formula C24H30FIO6 and molecular weight 560.4 g/mol. Its IUPAC systematic name is [2-[(8S,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-iodoacetate.
SBWPMXHFJJCNJZ-OWWZPINESA-N.
SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)CI)O)C)O)F)C.
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