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CHEBI:186468 - PC(4:0/4:0)

ChEBI IDCHEBI:186468
ChEBI NamePC(4:0/4:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H32NO8P
Net Charge0
Average Mass397.405
Monoisotopic Mass397.18655
SMILESCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC
InChIInChI=1S/C16H32NO8P/c1-6-8-15(18)22-12-14(25-16(19)9-7-2)13-24-26(20,21)23-11-10-17(3,4)5/h14H,6-13H2,1-5H3/t14-/m1/s1
InChIKeyQIJYAMAPPUXBSC-CQSZACIVSA-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(4:0/4:0) (CHEBI:186468) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2,3-di(butanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01011222LIPID MAPS
167804ChemSpider
Registry NumbersSources
CAS:3355-26-8ChemIDplus