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CHEBI:187366 - OOV-PC

ChEBI IDCHEBI:187366
ChEBI NameOOV-PC
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H58NO9P
Net Charge0
Average Mass619.777
Monoisotopic Mass619.38492
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC=O
InChIInChI=1S/C31H58NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30(34)38-27-29(41-31(35)23-20-21-25-33)28-40-42(36,37)39-26-24-32(2,3)4/h12-13,25,29H,5-11,14-24,26-28H2,1-4H3/b13-12-/t29-/m1/s1
InChIKeyQIJHXUVSEDYOIU-BKAVPCLVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
OOV-PC (CHEBI:187366) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-3-[(Z)-octadec-9-enoyl]oxy-2-(5-oxopentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP20010028LIPID MAPS
113380804ChemSpider