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CHEBI:189114 - 1_18_1_lysophosphatidylcholine

ChEBI IDCHEBI:189114
ChEBI Name1_18_1_lysophosphatidylcholine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H52NO7P
Net Charge0
Average Mass521.676
Monoisotopic Mass521.34814
SMILESCCCCCCCC/C=C/CCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12+
InChIKeyYAMUFBLWGFFICM-OUKQBFOZSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1_18_1_lysophosphatidylcholine (CHEBI:189114) is a 1-O-acyl-sn-glycero-3-phosphocholine (CHEBI:58168)
IUPAC Name 
[2-hydroxy-3-[(E)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
13238137ChemSpider