EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:90972 - glycopyrronium bromide

Default Structure
ChEBI IDCHEBI:90972
ChEBI Nameglycopyrronium bromide
Stars
DefinitionA quaternary ammonium salt composed of 3-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-1,1-dimethylpyrrolidin-1-ium and bromide ions in a 1:1 ratio.
Last Modified18 January 2016
SubmitterSteve
DownloadsMolfile
FormulaBr.C19H28NO3
Net Charge0
Average Mass398.341
Monoisotopic Mass397.12526
SMILESC[N+]1(C)CCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1.[Br-]
InChIInChI=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
InChIKeyVPNYRYCIDCJBOM-UHFFFAOYSA-M
Roles Classification
Applications:
anti-asthmatic agent  Any compound that has anti-asthmatic effects.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
renoprotective agent  Any compound that is able to prevent damage to the kidneys.
ChEBI Ontology
Outgoing Relation(s)
glycopyrronium bromide (CHEBI:90972) has role anti-asthmatic agent (CHEBI:65023)
glycopyrronium bromide (CHEBI:90972) has role antidepressant (CHEBI:35469)
glycopyrronium bromide (CHEBI:90972) has role renoprotective agent (CHEBI:231911)
glycopyrronium bromide (CHEBI:90972) is a organic bromide salt (CHEBI:48369)
glycopyrronium bromide (CHEBI:90972) is a quaternary ammonium salt (CHEBI:35273)
Incoming Relation(s)
(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  Source
bromure de glycopyrroniumChemIDplus
bromuro de glicopirronioChemIDplus
glycopyrronii bromidumChemIDplus
glycopyrronium bromideChemIDplus
Synonyms  Source
1,1-Dimethyl-3-hydroxypyrrolidinium bromide alpha-cyclopentylmandelateChemIDplus
1-Methyl-3-pyrrolidyl alpha-phenylcyclopentaneglycolate methobromideChemIDplus
3-Hydroxy-1,1-dimethylpyrrolidinium bromide alpha-cyclopentylmandelateChemIDplus
AD-237ChEMBL
AHR-504ChEMBL
CHF-5259ChEMBL
Brand Names  Source
CuvposaChEMBL
Dartisla odtChEMBL
Enurev breezhalerChEMBL
Glycopyrrolate component of prevduoChEMBL
Glycopyrrolate component of utibronChEMBL
Glycopyrronium bromide component of bevespi aerosphere glycopyrrolateChEMBL
Registry NumbersSources
Reaxys:3642926Reaxys
CAS:596-51-0ChemIDplus
Citations