6-Dehydrofluorocortisol acetate structure

6-Dehydrofluorocortisol acetate

[2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

Also Known As: 6-Dehydro-FCAC|6-Dehydrofluorocortisol acetate|6-Dehydro-9alpha-fluorocortisol acetate|6-dehydro-9 alpha-fluorocortisol acetate|[2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate|Pregna-4,6-diene-3,20-dione, 21-(acetyloxy)-9-fluoro-11,17-dihydroxy-, (11beta)-|9-Fluoro-11,17-dihydroxy-3,20-dioxopregna-4,6-dien-21-yl acetate|(9xi)-9-Fluoro-11beta,17-dihydroxy-3,20-dioxopregna-4,6-dien-21-yl acetate

CAS: 564-57-8
Molecular Formula C23H29FO6
Molecular Weight 420.19482 g/mol
LogP 2.2205
Topological Polar Surface Area 100.9 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 420.19482
Monoisotopic Mass 420.19482
Heavy Atoms 30
Complexity 878.9191

Chemical Identifiers

CAS Number 564-57-8
SMILES CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H](C3([C@H]2C=CC4=CC(=O)CC[C@@]43C)F)O)C)O

Product Overview

6-Dehydrofluorocortisol acetate (CAS 564-57-8), with molecular formula C23H29FO6 and molecular weight 420.19482 g/mol. IUPAC: [2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.

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