CHEBI:133693 - oleoylcholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name oleoylcholine
ChEBI ID CHEBI:133693
Definition An acylcholine obtained by formal condensation of the carboxy group of oleic acid with the hydroxy group of choline.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H46NO2
Net Charge +1
Average Mass 368.618
Monoisotopic Mass 368.35231
InChI InChI=1S/C23H46NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(25)26-22-21-24(2,3)4/h12-13H,5-11,14-22H2,1-4H3/q+1/b13-12-
InChIKey PVXGXBXEHLTWOE-SEYXRHQNSA-N
SMILES CCCCCCCC/C=C\CCCCCCCC(OCC[N+](C)(C)C)=O
ChEBI Ontology
Outgoing oleoylcholine (CHEBI:133693) has functional parent oleic acid (CHEBI:16196)
oleoylcholine (CHEBI:133693) is a acylcholine (CHEBI:35287)
IUPAC Name
N,N,N-trimethyl-2-{[(9Z)-octadec-9-enoyl]oxy}ethan-1-aminium
Synonyms Sources
(9Z)-octadecenoylcholine ChEBI
choline (9Z)-octadecenoate ChEBI
choline oleate ChEBI
Last Modified
07 October 2016