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CHEBI:185998 - PA(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

ChEBI IDCHEBI:185998
ChEBI NamePA(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Stars
Last Modified29 May 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H69O7P
Net Charge0
Average Mass704.970
Monoisotopic Mass704.47809
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C41H69O7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-41(42)48-40(39-47-49(43,44)45)38-46-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24,26,30,32,35,37,40H,3-4,6,8-10,12,14-16,18,20,23,25,27-29,31,33-34,36,38-39H2,1-2H3,(H2,43,44,45)/b7-5-,13-11-,19-17-,22-21-,26-24-,32-30-,37-35-/t40-/m1/s1
InChIKeyKPEBIWBYDZHMKV-QTUSOVKZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
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(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (CHEBI:185998) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name 
[(2R)-1-[(Z)-hexadec-1-enoxy]-3-phosphonooxypropan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Manual XrefsDatabases
113379493ChemSpider
LMGP10030093LIPID MAPS