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CHEBI:228657 - LPC 21:2

ChEBI IDCHEBI:228657
ChEBI NameLPC 21:2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H56NO7P
Net Charge0
Average Mass561.741
Monoisotopic Mass561.37944
SMILESCCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C29H56NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-29(32)35-26-28(31)27-37-38(33,34)36-25-24-30(2,3)4/h10-11,13-14,28,31H,5-9,12,15-27H2,1-4H3/b11-10-,14-13-
InChIKeyYPXHZZWYVBYUBD-XVTLYKPTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
LPC 21:2 (CHEBI:228657) is a 1-O-acyl-sn-glycero-3-phosphocholine (CHEBI:58168)
IUPAC Name 
[3-[(11Z,14Z)-henicosa-11,14-dienoyl]oxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate