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CHEBI:185317 - PA(17:2(9Z,12Z)/0:0)

ChEBI IDCHEBI:185317
ChEBI NamePA(17:2(9Z,12Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H37O7P
Net Charge0
Average Mass420.483
Monoisotopic Mass420.22769
SMILESCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)O
InChIInChI=1S/C20H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(22)26-17-19(21)18-27-28(23,24)25/h5-6,8-9,19,21H,2-4,7,10-18H2,1H3,(H2,23,24,25)/b6-5-,9-8-/t19-/m1/s1
InChIKeyBZKPZZCBZNVVMB-REFGTHLASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
PA(17:2(9Z,12Z)/0:0) (CHEBI:185317) is a 1-acyl-sn-glycerol 3-phosphate (CHEBI:16975)
IUPAC Name 
[(2R)-2-hydroxy-3-phosphonooxypropyl] (9Z,12Z)-heptadeca-9,12-dienoate
Manual XrefsDatabases
LMGP10050022LIPID MAPS
113379496ChemSpider