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CHEBI:196765 - PA(13:0/21:0)

ChEBI IDCHEBI:196765
ChEBI NamePA(13:0/21:0)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H73O8P
Net Charge0
Average Mass676.957
Monoisotopic Mass676.50431
SMILESCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C37H73O8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-37(39)45-35(34-44-46(40,41)42)33-43-36(38)31-29-27-25-23-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3,(H2,40,41,42)/t35-/m1/s1
InChIKeySSCDMFSLJVPNPI-PGUFJCEWSA-N
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(13:0/21:0) (CHEBI:196765) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-phosphonooxy-3-tridecanoyloxypropan-2-yl] henicosanoate
Manual XrefsDatabases
113379300ChemSpider
LMGP10010934LIPID MAPS