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CHEBI:135977 - dodeclonium bromide

ChEBI IDCHEBI:135977
ChEBI Namedodeclonium bromide
Stars
DefinitionThe organic bromide salt of dodeclonium. It is an antispetic drug and an ingredient found in creams such as Phlebocreme and Sedorrhoide which are recommended for use in some painful anal pathologies (hemorrhoidal crisis).
Last Modified12 November 2020
DownloadsMolfile
FormulaBr.C22H39ClNO
Net Charge0
Average Mass448.917
Monoisotopic Mass447.19035
SMILESCCCCCCCCCCCC[N+](C)(C)CCOc1ccc(Cl)cc1.[Br-]
InChIInChI=1S/C22H39ClNO.BrH/c1-4-5-6-7-8-9-10-11-12-13-18-24(2,3)19-20-25-22-16-14-21(23)15-17-22;/h14-17H,4-13,18-20H2,1-3H3;1H/q+1;/p-1
InChIKeyCKGHXNXUAQJNMJ-UHFFFAOYSA-M
Roles Classification
Application:
antiseptic drug  A substance used locally on humans and other animals to destroy harmful microorganisms or to inhibit their activity (cf. disinfectants, which destroy microorganisms found on non-living objects, and antibiotics, which can be transported through the lymphatic system to destroy bacteria within the body).
ChEBI Ontology
Outgoing Relation(s)
dodeclonium bromide (CHEBI:135977) has part dodeclonium (CHEBI:166833)
dodeclonium bromide (CHEBI:135977) has role antiseptic drug (CHEBI:48218)
dodeclonium bromide (CHEBI:135977) is a organic bromide salt (CHEBI:48369)
IUPAC Name 
N-[2-(4-chlorophenoxy)ethyl]-N,N-dimethyldodecan-1-aminium bromide
INNs  Source
dodeclonium bromideWHO MedNet
bromure de dodécloniumWHO MedNet
dodeclonii bromidumWHO MedNet
bromuro de dodeclonioWHO MedNet
Synonyms  Source
GR 412ChemIDplus
[2-(4-chlorophenoxy)ethyl](dodecyl)dimethylazanium bromideChEBI
GR-412ChEBI
(2-(p-chlorophenoxy)ethyl)dodecyldimethylammonium bromideChemIDplus
Manual XrefsDatabases
4462DrugCentral
Registry NumbersSources
CAS:15687-13-5ChemIDplus
Citations