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CHEBI:191605 - PGP(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(11Z))

ChEBI IDCHEBI:191605
ChEBI NamePGP(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(11Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H78O13P2
Net Charge0
Average Mass901.065
Monoisotopic Mass900.49177
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)O)OC(=O)CCCCCCCCC/C=C\CCCCCC
InChIInChI=1S/C46H78O13P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-37-45(48)55-41-44(42-58-61(53,54)57-40-43(47)39-56-60(50,51)52)59-46(49)38-36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,21-22,25,27,31,33,43-44,47H,3-4,6,8-10,12,15,18,20,23-24,26,28-30,32,34-42H2,1-2H3,(H,53,54)(H2,50,51,52)/b7-5-,13-11-,16-14-,19-17-,22-21-,27-25-,33-31-/t43-,44+/m0/s1
InChIKeyOKIXLWJAVIWEHV-JZWMAQNHSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
PGP(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(11Z)) (CHEBI:191605) is a phosphatidylglycerol phosphate (CHEBI:17264)
IUPAC Name 
[(2R)-3-[hydroxy-[(2S)-2-hydroxy-3-phosphonooxypropoxy]phosphoryl]oxy-2-[(Z)-octadec-11-enoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Manual XrefsDatabases
74878220ChemSpider
HMDB0116508HMDB