The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

cetalkonium chloride

Synonyms

benzyldimethylcetylammonium chloride

benzylhexadecyldimethylammonium chloride

dimethylbenzylhexadecylammonium chloride

hexadecylbenzyldimethylammonium chloride

hexadecyldimethylbenzylammonium chloride

benzyldimethylhexadecylammonium chloride

cetyldimethylbenzylammonium chloride

benzylcetyldimethylammonium chloride

dimethylbenzylcetylammonium chloride

cetylbenzyldimethylammonium chloride

benzaletas

cetylon

ID

http://purl.obolibrary.org/obo/CHEBI_135523

charge

+1

database_cross_reference

CAS:122-18-9

Drug_Central:3078

formula

C25H46N

has_obo_namespace

chebi_ontology

has_related_synonym

benzyldimethylcetylammonium chloride

benzylhexadecyldimethylammonium chloride

dimethylbenzylhexadecylammonium chloride

hexadecylbenzyldimethylammonium chloride

hexadecyldimethylbenzylammonium chloride

benzyldimethylhexadecylammonium chloride

cetyldimethylbenzylammonium chloride

benzylcetyldimethylammonium chloride

dimethylbenzylcetylammonium chloride

cetylbenzyldimethylammonium chloride

benzaletas

cetylon

has_RxCUI

47907

id

CHEBI:135523

in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR

inchi

InChI=1S/C25H46N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25/h17-19,21-22H,4-16,20,23-24H2,1-3H3/q+1

inchikey

QDYLMAYUEZBUFO-UHFFFAOYSA-N

label

cetalkonium chloride

mass

360.640

monoisotopicmass

360.36248

notation

CHEBI:135523

prefLabel

cetalkonium chloride

smiles

C([N+](CCCCCCCCCCCCCCCC)(C)C)C1=CC=CC=C1

subClassOf

http://purl.obolibrary.org/obo/CHEBI_33860

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