EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:170295 - PA(22:4(7Z,10Z,13Z,16Z)/16:0)

ChEBI IDCHEBI:170295
ChEBI NamePA(22:4(7Z,10Z,13Z,16Z)/16:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H73O8P
Net Charge0
Average Mass725.001
Monoisotopic Mass724.50431
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C41H73O8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-35-40(42)47-37-39(38-48-50(44,45)46)49-41(43)36-34-32-30-28-26-23-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,24-25,39H,3-10,12,14-16,19,22-23,26-38H2,1-2H3,(H2,44,45,46)/b13-11-,18-17-,21-20-,25-24-/t39-/m1/s1
InChIKeyLDYXBNUGLKWLSN-FUGBMDIYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) 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(22:4(7Z,10Z,13Z,16Z)/16:0) (CHEBI:170295) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-2-hexadecanoyloxy-3-phosphonooxypropyl] (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
Manual XrefsDatabases
74877066ChemSpider
HMDB0115326HMDB
LMGP10010792LIPID MAPS