5-Iodomethyl 6α,9α-difluoro-11β-hydroxy-16α-methyl-3-oxo-17α-(propionyloxy)-androsta-1,4-diene-17β-carbothioate

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Catalog Number
ACM80474675
Product Name
5-Iodomethyl 6α,9α-difluoro-11β-hydroxy-16α-methyl-3-oxo-17α-(propionyloxy)-androsta-1,4-diene-17β-carbothioate
Structure
Structure
CAS
80474-67-5
Category
Heterocyclic Organic Compound
Synonyms
(6α,11?,16α,17α)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-androsta-1,4-diene-17-carbothioic acid, , S-(iodomethyl) ester
IUPAC Name
[(8S,10S,11S,13S)-6,9-difluoro-11-hydroxy-17-(iodomethylsulfanylcarbonyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
Molecular Weight
608.48
Molecular Formula
C25H31F2IO5S
Canonical SMILES
CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)SCI
InChI Key
HKRIRGIBBWVEFV-KIOLIBKASA-N
Appearance
Off-White Solid
Exact Mass
608.09000
H-Bond Acceptor
8
H-Bond Donor
1
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