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CHEBI:170385 - PA(20:2(11Z,14Z)/18:1(9Z))

ChEBI IDCHEBI:170385
ChEBI NamePA(20:2(11Z,14Z)/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H75O8P
Net Charge0
Average Mass727.017
Monoisotopic Mass726.51996
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C41H75O8P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-40(42)47-37-39(38-48-50(44,45)46)49-41(43)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11,13,17-19,21,39H,3-10,12,14-16,20,22-38H2,1-2H3,(H2,44,45,46)/b13-11-,19-17-,21-18-/t39-/m1/s1
InChIKeyLRTCKJJOUNZFDD-DBHIXKHWSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(20:2(11Z,14Z)/18:1(9Z)) (CHEBI:170385) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-2-[(Z)-octadec-9-enoyl]oxy-3-phosphonooxypropyl] (11Z,14Z)-icosa-11,14-dienoate
Manual XrefsDatabases
LMGP10010568LIPID MAPS
74877277ChemSpider
HMDB0115539HMDB