[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide
-
![[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/357a11052707415aa5094f7be576ee4c.png "[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide")
[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide
structure -
-
CAS No:
14668-13-4
-
Formula:
C27H44BrNO3
-
Chemical Name:
[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide
-
Synonyms:
14668-13-4;1-(3-alpha-Hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)-1-methylpiperidinium bromide acetate;3-alpha-Acetoxy-2-beta-piperidino-5-alpha-androstan-17-one methobromide;Piperidinium, 1-(3-alpha-hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)-1-methyl-, bromide, acetate;DTXSID30932885;3-(Acetyloxy)-2-(1-methylpiperidin-1-ium-1-yl)-17-oxoandrostane bromide
-
CAS No:
[(2S,3S,5S,10S,13S)-10,13-dimethyl-2-(1-methylpiperidin-1-ium-1-yl)-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate;bromide Basic Attributes
510.5 g/mol
509.25046 g/mol
Computed Properties
Molecular Weight:510.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:509.25046
Monoisotopic Mass:509.25046
Topological Polar Surface Area:43.4
Heavy Atom Count:32
Complexity:743
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Request for Quotation