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Structure

Cloticasone propionate

CAS
80486-69-7
Catalog Number
ACM80486697
Category
Other Products
Molecular Weight
517.03
Molecular Formula
C25H31ClF2O5S

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Specification

Synonyms
5-Chloromethyl 6α,9α-Difluoro-11β-hydroxy-16α-methyl-3-oxo-17α-(propionyloxy)
-androsta-1,4-diene-17β-carbothioate; (6α.,11β,16α,17α)-6,9-Difluoro-11-hydroxy-16
-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbothioic Acid
IUPAC Name
[(6S,9R,10S,11S,13S,14S,16R,17R)-17-(chloromethylsulfanylcarbonyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
Canonical SMILES
CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)SCCl
InChI Key
MVLBCBPGBUAVJQ-ZHLGSTKJSA-N
Appearance
Off-White Solid
Exact Mass
516.15500
H-Bond Acceptor
7
H-Bond Donor
1
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