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CHEBI:196716 - PA(16:0/17:1(9Z))

ChEBI IDCHEBI:196716
ChEBI NamePA(16:0/17:1(9Z))
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SubmitterMetaboLights
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FormulaC36H69O8P
Net Charge0
Average Mass660.914
Monoisotopic Mass660.47301
SMILESCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C36H69O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(38)44-34(33-43-45(39,40)41)32-42-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17,34H,3-14,16,18-33H2,1-2H3,(H2,39,40,41)/b17-15-/t34-/m1/s1
InChIKeyZTSPZXCCNTZUNO-SGBZAWJXSA-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(16:0/17:1(9Z)) (CHEBI:196716) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-hexadecanoyloxy-3-phosphonooxypropan-2-yl] (Z)-heptadec-9-enoate
Manual XrefsDatabases
LMGP10010909LIPID MAPS
113379293ChemSpider