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CHEBI:185167 - PA(O-18:0/22:1(11Z))

ChEBI IDCHEBI:185167
ChEBI NamePA(O-18:0/22:1(11Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H85O7P
Net Charge0
Average Mass745.120
Monoisotopic Mass744.60329
SMILESCCCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C43H85O7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-43(44)50-42(41-49-51(45,46)47)40-48-39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h21-22,42H,3-20,23-41H2,1-2H3,(H2,45,46,47)/b22-21-/t42-/m1/s1
InChIKeyZGSZGAIXTBZRTP-KNWKQHDPSA-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(O-18:0/22:1(11Z)) (CHEBI:185167) is a ether lipid (CHEBI:64611)
PA(O-18:0/22:1(11Z)) (CHEBI:185167) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name 
[(2R)-1-octadecoxy-3-phosphonooxypropan-2-yl] (Z)-docos-11-enoate
Manual XrefsDatabases
113379352ChemSpider
LMGP10020039LIPID MAPS