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CHEBI:183142 - PA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

ChEBI IDCHEBI:183142
ChEBI NamePA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC45H79O7P
Net Charge0
Average Mass763.094
Monoisotopic Mass762.55634
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C45H79O7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-45(46)52-44(43-51-53(47,48)49)42-50-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23-24,28,30,34,36,44H,3-4,6,8-10,12,14-16,18,20-22,25-27,29,31-33,35,37-43H2,1-2H3,(H2,47,48,49)/b7-5-,13-11-,19-17-,24-23-,30-28-,36-34-/t44-/m1/s1
InChIKeyNLKRKDZDKRZFRB-MACLQNLPSA-N
Species of MetaboliteComponentSourceComments
Trypanosoma brucei (ncbitaxon:5691) cell culture (BTO:0000214) MetaboLights (MTBLS2559)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
PA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (CHEBI:183142) is a ether lipid (CHEBI:64611)
PA(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (CHEBI:183142) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name 
[(2R)-1-icosoxy-3-phosphonooxypropan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Manual XrefsDatabases
113379383ChemSpider
LMGP10020070LIPID MAPS