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CHEBI:178505 - PA(21:0/14:1(9Z))

ChEBI IDCHEBI:178505
ChEBI NamePA(21:0/14:1(9Z))
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FormulaC38H73O8P
Net Charge0
Average Mass688.968
Monoisotopic Mass688.50431
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C38H73O8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-32-37(39)44-34-36(35-45-47(41,42)43)46-38(40)33-31-29-27-25-22-14-12-10-8-6-4-2/h10,12,36H,3-9,11,13-35H2,1-2H3,(H2,41,42,43)/b12-10-/t36-/m1/s1
InChIKeyGJGIDANDUCQSLL-RENWGTOJSA-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(21:0/14:1(9Z)) (CHEBI:178505) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-3-phosphonooxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] henicosanoate
Manual XrefsDatabases
LMGP10010676LIPID MAPS