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Structure

9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 21-isonicotinate

CAS
94135-31-6
Catalog Number
ACM94135316
Category
Other Products
Molecular Weight
497.555183 [g/mol]
Molecular Formula
C28H32FNO6

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Specification

Synonyms
CTK5H5310, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 21-isonicotinate, 94135-31-6, AG-H-87492
IUPAC Name
[2-[(8S,9R,10S,11S,13S,14S,16S,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] pyridine-4-carboxylate
Canonical SMILES
CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C5=CC=NC=C5)O)C)O)F)C
InChI Key
BQTXJHAJMDGOFI-QEVRMTOFSA-N
EC Number
302-900-1
H-Bond Acceptor
8
H-Bond Donor
2
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