CHEBI:90972 - glycopyrronium bromide

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ChEBI Name glycopyrronium bromide
ChEBI ID CHEBI:90972
Definition A quaternary ammonium salt composed of 3-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-1,1-dimethylpyrrolidin-1-ium and bromide ions in a 1:1 ratio.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H28BrNO3
Net Charge 0
Average Mass 398.335
Monoisotopic Mass 397.12526
InChI InChI=1S/C19H28NO3.BrH/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3;1H/q+1;/p-1
InChIKey VPNYRYCIDCJBOM-UHFFFAOYSA-M
SMILES [Br-].C(C(OC1C[N+](CC1)(C)C)=O)(C2CCCC2)(C=3C=CC=CC3)O
ChEBI Ontology
Outgoing glycopyrronium bromide (CHEBI:90972) is a organic bromide salt (CHEBI:48369)
glycopyrronium bromide (CHEBI:90972) is a quaternary ammonium salt (CHEBI:35273)
Incoming (2R,3S)-glycopyrronium bromide (CHEBI:90974) is a glycopyrronium bromide (CHEBI:90972)
(2S,3R)-glycopyrronium bromide (CHEBI:90973) is a glycopyrronium bromide (CHEBI:90972)
IUPAC Name
3-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-1,1-dimethylpyrrolidin-1-ium bromide
INNs Sources
bromure de glycopyrronium ChemIDplus
bromuro de glicopirronio ChemIDplus
glycopyrronii bromidum ChemIDplus
glycopyrronium bromide ChemIDplus
Synonyms Sources
1,1-Dimethyl-3-hydroxypyrrolidinium bromide alpha-cyclopentylmandelate ChemIDplus
1-Methyl-3-pyrrolidyl alpha-phenylcyclopentaneglycolate methobromide ChemIDplus
3-Hydroxy-1,1-dimethylpyrrolidinium bromide alpha-cyclopentylmandelate ChemIDplus
Registry Numbers Types Sources
3642926 Reaxys Registry Number Reaxys
596-51-0 CAS Registry Number ChemIDplus
Last Modified
18 January 2016