(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile
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![(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e7df141fc9714f6980ecd75e9ee2b62a.png "(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile")
(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile
structure -
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CAS No:
95160-20-6
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Formula:
C22H29NO2
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Chemical Name:
(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile
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Synonyms:
2-cyanoprogesterone;2-Cyanoprogesterone;95160-20-6;DTXSID40915083;3,20-Dioxopregn-4-ene-2-carbonitrile;(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile;Pregn-4-ene-2-carbonitrile, 3,20-dioxo-, (2-alpha)-
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CAS No:
(2S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2-carbonitrile Basic Attributes
339.5 g/mol
339.219829168 g/mol
Computed Properties
Molecular Weight:339.5
XLogP3:3.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:339.219829168
Monoisotopic Mass:339.219829168
Topological Polar Surface Area:57.9
Heavy Atom Count:25
Complexity:713
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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