C23H27BrF2O7

[2-[(6R,8S,10S,11S,13S,14S,16R)-2-bromo-6,9-difluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

Also Known As: EINECS 260-955-6|KST-1A6333|(6|A,9xi,11|A,16|A,17xi)-2-bromo-6,9-difluoro-11,16,17-trihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate|[2-[(6R,8S,10S,11S,13S,14S,16R)-2-bromo-6,9-difluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate|2-Bromo-6,9-difluoro-11,16,17-trihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate|(9xi,17xi)-2-Bromo-6beta,9-difluoro-11beta,16alpha,17-trihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate|2-Bromo-6|A,9|A-difluoro-1,4-pregnadiene-11|A,16|A,17|A,21-tetrol-3,20-dione 21-acetate|2-Bromo-6beta,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 21-acetate

Molecular Formula	C23H27BrF2O7
Molecular Weight	532.0908 g/mol
LogP	1.86
Topological Polar Surface Area	121.13 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	532.0908
Heavy Atoms	33
Complexity	997.3

Chemical Identifiers

CAS Number	57781-19-8
SMILES	CC(=O)OCC(=O)C1([C@@H](C[C@@H]2[C@@]1(C[C@@H](C3([C@H]2C[C@H](C4=CC(=O)C(=C[C@@]43C)Br)F)F)O)C)O)O