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CHEBI:191367 - PC(18:2(9Z,12Z)/24:1(15Z))

ChEBI IDCHEBI:191367
ChEBI NamePC(18:2(9Z,12Z)/24:1(15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC50H94NO8P
Net Charge0
Average Mass868.275
Monoisotopic Mass867.67171
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C50H94NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h15,17,20-22,28,48H,6-14,16,18-19,23-27,29-47H2,1-5H3/b17-15-,22-20-,28-21-/t48-/m1/s1
InChIKeyWVHWGPQZBQVWOW-PWXNSLKKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
PC(18:2(9Z,12Z)/24:1(15Z)) (CHEBI:191367) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-2-[(Z)-tetracos-15-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
HMDB0008158HMDB
24766820ChemSpider