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chlormadinone acetate

Structure via PubChem · Public domain (PubChem)

EntityQ5102980· pop 7· linked from 1,182 articles

chlormadinone acetate

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chemical compound

Chemical data

Formula
C23H29ClO4
Molecular weight
404.9 g/mol
IUPAC name
[(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-oxo-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
SMILES
CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)CC[C@]34C)Cl)C)OC(=O)C
InChIKey
QMBJSIBWORFWQT-DFXBJWIESA-N
XLogP
3.6
Polar surface area
60.4 Ų
H-bond donors
0
H-bond acceptors
4
Formal charge
0

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Research

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Wikidata facts

Mass
404.17543708799997
Show 6 more facts
chemical formula
C₂₃H₂₉ClO₄
isomeric SMILES
CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)CC[C@]34C)Cl)C)OC(=O)C
NCI Thesaurus ID
C365
subject has role
antiandrogen
Commons category
Chlormadinone acetate
canonical SMILES
CC(=O)OC1(C(C)=O)CCC2C3C=C(Cl)C4=CC(=O)CCC4(C)C3CCC21C
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