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CHEBI:178742 - PA(16:1(9Z)/20:0)

ChEBI IDCHEBI:178742
ChEBI NamePA(16:1(9Z)/20:0)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC39H75O8P
Net Charge0
Average Mass702.995
Monoisotopic Mass702.51996
SMILESCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C39H75O8P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(41)47-37(36-46-48(42,43)44)35-45-38(40)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h14,16,37H,3-13,15,17-36H2,1-2H3,(H2,42,43,44)/b16-14-/t37-/m1/s1
InChIKeyIMWZXEQEWLZEPV-UHGNNPBBSA-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(16:1(9Z)/20:0) (CHEBI:178742) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-[(Z)-hexadec-9-enoyl]oxy-3-phosphonooxypropan-2-yl] icosanoate
Manual XrefsDatabases
75336467ChemSpider
LMGP10010214LIPID MAPS