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CHEBI:191086 - Pc(16:1e/9-hode)

ChEBI IDCHEBI:191086
ChEBI NamePc(16:1e/9-hode)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H80NO8P
Net Charge0
Average Mass758.075
Monoisotopic Mass757.56216
SMILESCCCCC/C=C\C=C\C(O)CCCCCCCC(=O)OC(CO/C=C\CCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C42H80NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-22-27-31-36-48-38-41(39-50-52(46,47)49-37-35-43(3,4)5)51-42(45)34-30-26-23-25-29-33-40(44)32-28-24-21-13-11-9-7-2/h21,24,28,31-32,36,40-41,44H,6-20,22-23,25-27,29-30,33-35,37-39H2,1-5H3/b24-21-,32-28+,36-31-
InChIKeyVBUMYHGMAFIBQK-XMIOJHFOSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Pc(16:1e/9-hode) (CHEBI:191086) is a 1-(alk-1-enyl)-2-acyl-glycero-3-phosphocholine (CHEBI:78188)
IUPAC Name 
[3-[(Z)-hexadec-1-enoxy]-2-[(10E,12Z)-9-hydroxyoctadeca-10,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate