EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:754458 - lauralkonium

Default Structure
ChEBI IDCHEBI:754458
ChEBI Namelauralkonium
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H44NO2
Net Charge+1
Average Mass438.676
Monoisotopic Mass438.33666
SMILESCCCCCCCCCCCC(=O)c1ccc(OCC[N+](C)(C)Cc2ccccc2)cc1
InChIInChI=1S/C29H44NO2/c1-4-5-6-7-8-9-10-11-15-18-29(31)27-19-21-28(22-20-27)32-24-23-30(2,3)25-26-16-13-12-14-17-26/h12-14,16-17,19-22H,4-11,15,18,23-25H2,1-3H3/q+1
InChIKeyPONRVFMQIXWVLG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
lauralkonium (CHEBI:754458) is a aromatic ketone (CHEBI:76224)
Synonyms  Source
Lauralkonium cationChEMBL
Lauralkonium ionChEMBL