9-Fluoro-11beta,21-dihydroxypregna-1,4,16-triene-3,20-dione 21-acetate
[2-[(8S,9R,10S,11S,13S,14S)-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: EINECS 215-006-0|KST-1A0979|9-Fluoro-11beta,21-dihydroxypregna-1,4,16-triene-3,20-dione 21-acetate|[2-[(8S,9R,10S,11S,13S,14S)-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate|(11|A)-9-fluoro-11-hydroxy-3,20-dioxopregna-1,4,16-trien-21-yl acetate|21-Acetoxy-9a-fluoro-11b-hydroxypregna-1,4,16-triene-3,20-dione|21-Acetoxy-9alpha-fluoro-11beta-hydroxypregna-1,4,16-triene-3,20-dione|Pregna-1,4,16-triene-3,20-dione, 21-(acetyloxy)-9-fluoro-11-hydroxy-, (11beta)-|21-Acetoxy-9|A-fluoro-11|A-hydroxypregna-1,4,16-triene-3,20-dione|21-acetoxy-9alpha-fluoro-11beta-hydroxy-pregna-1,4,16-triene-3,20-dione|21-Acetyloxy-9-fluoro-11beta-hydroxypregna-1,4,16-triene-3,20-dione|9-Fluoro-11|A,21-dihydroxy-pregna-1,4,16-triene-3,20-dione 21-Acetate|9-Fluoro-11beta,21-dihydroxy-pregna-1,4,16-triene-3,20-dione 21-Acetate|9-Fluoro-11beta-hydroxy-3,20-dioxopregna-1,4,16-trien-21-yl acetate|(11|A)-21-(Acetyloxy)-9-fluoro-11-hydroxypregna-1,4,16-triene-3,20-dione|Pregna-1,4,16-triene-3,20-dione,21-(acetyloxy)-9-fluoro-11-hydroxy-, (11b)-|2-[(3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-10-hydroxy-9a,11a-dimethyl-7-oxo-3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl acetate
| Molecular Formula | C23H27FO5 |
|---|---|
| Molecular Weight | 402.18427 g/mol |
| LogP | 3.03 |
| Topological Polar Surface Area | 80.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.18427 |
| Heavy Atoms | 29 |
| Complexity | 885.7 |
Chemical Identifiers
| CAS Number | 1250-85-7 |
|---|---|
| SMILES | CC(=O)OCC(=O)C1=CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C |
Product Overview
9-Fluoro-11beta,21-dihydroxypregna-1,4,16-triene-3,20-dione 21-acetate (CAS 1250-85-7), with molecular formula C23H27FO5 and molecular weight 402.18427 g/mol. IUPAC: [2-[(8S,9R,10S,11S,13S,14S)-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
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