[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride
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![[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/459f84a089ac4fb99075f5946a131979.png "[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride")
[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride
structure -
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CAS No:
109345-60-0
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Formula:
C30H38ClNO2
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Chemical Name:
[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride
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Synonyms:
mifepristone methochloride;RU 486 methochloride;RU 486 Methochloride;Mifepristone methochloride;109345-60-0;SCHEMBL15094070;Benzenaminium, 4-((11beta,17beta)-17-hydroxy-3-oxo-17-(1-propynyl)estra-4,9-dien-11-yl)-N,N,N-trimethyl-, chloride
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CAS No:
[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride Basic Attributes
480.1 g/mol
479.2591071 g/mol
Computed Properties
Molecular Weight:480.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:479.2591071
Monoisotopic Mass:479.2591071
Topological Polar Surface Area:37.3
Heavy Atom Count:34
Complexity:960
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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