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CHEBI:187843 - PC(15:1(9Z)/22:4(7Z,10Z,13Z,16Z))

ChEBI IDCHEBI:187843
ChEBI NamePC(15:1(9Z)/22:4(7Z,10Z,13Z,16Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC45H80NO8P
Net Charge0
Average Mass794.108
Monoisotopic Mass793.56216
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C45H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46(3,4)5)41-51-44(47)37-35-33-31-29-27-19-17-15-13-11-9-7-2/h14-17,20-21,23-24,26,28,43H,6-13,18-19,22,25,27,29-42H2,1-5H3/b16-14-,17-15-,21-20-,24-23-,28-26-/t43-/m1/s1
InChIKeyWAPXBANBEZLTSP-QGWAXJLVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PC(15:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (CHEBI:187843) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy-3-[(Z)-pentadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01011460LIPID MAPS
113374964ChemSpider