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CHEBI:170502 - PA(20:4(5Z,8Z,11Z,14Z)/20:1(11Z))

ChEBI IDCHEBI:170502
ChEBI NamePA(20:4(5Z,8Z,11Z,14Z)/20:1(11Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H75O8P
Net Charge0
Average Mass751.039
Monoisotopic Mass750.51996
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C43H75O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(44)49-39-41(40-50-52(46,47)48)51-43(45)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17-20,23,25,29,31,41H,3-10,12,14-16,21-22,24,26-28,30,32-40H2,1-2H3,(H2,46,47,48)/b13-11-,19-17-,20-18-,25-23-,31-29-/t41-/m1/s1
InChIKeyPKEIEZADWNOVAN-MNTTZMHZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(20:4(5Z,8Z,11Z,14Z)/20:1(11Z)) (CHEBI:170502) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-phosphonooxypropan-2-yl] (Z)-icos-11-enoate
Manual XrefsDatabases
LMGP10010637LIPID MAPS
HMDB0115157HMDB
74876898ChemSpider