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CHEBI:178741 - PA(21:0/15:1(9Z))

ChEBI IDCHEBI:178741
ChEBI NamePA(21:0/15:1(9Z))
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SubmitterMetaboLights
DownloadsMolfile
FormulaC39H75O8P
Net Charge0
Average Mass702.995
Monoisotopic Mass702.51996
SMILESCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C39H75O8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-23-16-14-12-10-8-6-4-2/h12,14,37H,3-11,13,15-36H2,1-2H3,(H2,42,43,44)/b14-12-/t37-/m1/s1
InChIKeyFMJRRWZKFYBGHC-SVKAEJSDSA-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(21:0/15:1(9Z)) (CHEBI:178741) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-2-[(Z)-pentadec-9-enoyl]oxy-3-phosphonooxypropyl] henicosanoate
Manual XrefsDatabases
LMGP10010678LIPID MAPS