EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:752260 - mecetronium ethylsulfate

Default Structure
ChEBI IDCHEBI:752260
ChEBI Namemecetronium ethylsulfate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC20H44N.C2H5O4S
Net Charge0
Average Mass423.704
Monoisotopic Mass423.33823
SMILESCCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]
InChIInChI=1S/C20H44N.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;1-2-6-7(3,4)5/h5-20H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
InChIKeyUUHBNESUDPIHCI-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
mecetronium ethylsulfate (CHEBI:752260) is a sulfuric ester (CHEBI:26819)
INNs  Source
etilsulfate de mecetroniumWHO MedNet
etilsulfato de mecetronioWHO MedNet
Synonyms  Source
Cetyl ethyldimonium ethosulfateChEMBL
Cetyl-ethyldimonium ethosulfateChEMBL
Cetylethyldimonium ethosulfateChEMBL
Mecetronium ethylsulfateChEMBL
Mecetronium ethylsulphateChEMBL
Mecetronium etilsulfateChEMBL