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Structure

2-Bromo-6beta,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 21-acetate

CAS
57781-19-8
Catalog Number
ACM57781198
Category
Other Products
Molecular Weight
533.357 g/mol
Molecular Formula
C23H27BrF2O7

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Specification

Synonyms
EINECS 260-955-6, CID93800, 2-Bromo-6beta,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 21-acetate, 57781-19-8
IUPAC Name
[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
Canonical SMILES
CC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C(=CC43C)Br)F)F)O)C)O)O
InChI Key
JAWWELAUBJOEOF-XZJXIWRJSA-N
EC Number
260-955-6
H-Bond Acceptor
9
H-Bond Donor
3
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