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CHEBI:228774 - PC O-16:0_18:1

ChEBI IDCHEBI:228774
ChEBI NamePC O-16:0_18:1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H84NO7P
Net Charge0
Average Mass746.108
Monoisotopic Mass745.59854
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(COCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h20,22,41H,6-19,21,23-40H2,1-5H3/b22-20-
InChIKeySIEDNCDNGMIKST-XDOYNYLZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
PC O-16:0_18:1 (CHEBI:228774) is a 1-alkyl-2-acyl-glycero-3-phosphocholine (CHEBI:78186)
IUPAC Name 
[3-hexadecoxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
24822856ChemSpider