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CHEBI:192226 - PA(8:0/12:0)

ChEBI IDCHEBI:192226
ChEBI NamePA(8:0/12:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H45O8P
Net Charge0
Average Mass480.579
Monoisotopic Mass480.28521
SMILESCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC)COP(=O)(O)O
InChIInChI=1S/C23H45O8P/c1-3-5-7-9-10-11-12-14-16-18-23(25)31-21(20-30-32(26,27)28)19-29-22(24)17-15-13-8-6-4-2/h21H,3-20H2,1-2H3,(H2,26,27,28)/t21-/m1/s1
InChIKeyWQQVHVPHCZDELC-OAQYLSRUSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(8:0/12:0) (CHEBI:192226) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-octanoyloxy-3-phosphonooxypropan-2-yl] dodecanoate
Manual XrefsDatabases
HMDB0115483HMDB
74877221ChemSpider