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CHEBI:186669 - PA(P-16:0/18:4(6Z,9Z,12Z,15Z))

ChEBI IDCHEBI:186669
ChEBI NamePA(P-16:0/18:4(6Z,9Z,12Z,15Z))
Stars
Last Modified29 May 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H65O7P
Net Charge0
Average Mass652.894
Monoisotopic Mass652.44679
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C37H65O7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-37(38)44-36(35-43-45(39,40)41)34-42-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22,24,31,33,36H,3-4,6,8-10,12,14-16,18,20-21,23,25-30,32,34-35H2,1-2H3,(H2,39,40,41)/b7-5-,13-11-,19-17-,24-22-,33-31-/t36-/m1/s1
InChIKeyKFQZKRVSCCEOAQ-LVDJGFSASA-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-16:0/18:4(6Z,9Z,12Z,15Z)) (CHEBI:186669) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name 
[(2R)-1-[(Z)-hexadec-1-enoxy]-3-phosphonooxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
Manual XrefsDatabases
LMGP10030015LIPID MAPS
113379417ChemSpider