CHEBI:183147 - PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/21:0)

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ChEBI Name PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/21:0)
ChEBI ID CHEBI:183147
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C49H85O10P
Net Charge 0
Average Mass 865.183
Monoisotopic Mass 864.58804
InChI InChI=1S/C49H85O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-28-30-32-34-36-38-40-48(52)56-44-47(45-58-60(54,55)57-43-46(51)42-50)59-49(53)41-39-37-35-33-31-29-27-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23,25,28,30,34,36,46-47,50-51H,3-4,6,8-10,12,14-16,18,20-22,24,26-27,29,31-33,35,37-45H2,1-2H3,(H,54,55)/b7-5-,13-11-,19-17-,25-23-,30-28-,36-34-/t46-,47+/m0/s1
InChIKey YABRAUMPWWEKAJ-PZERPMSRSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)(OC[C@@H](O)CO)(O)=O
Metabolite of Species Details
Trypanosoma brucei (NCBI:txid5691) Found in cell culture (BTO:0000214). See: MetaboLights Study
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via phosphatidylglycerol )
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via phosphatidylglycerol )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/21:0) (CHEBI:183147) is a phosphatidylglycerol (CHEBI:17517)
IUPAC Name
[(2R)-3-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-henicosanoyloxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Manual Xrefs Databases
113377528 ChemSpider
LMGP04010841 LIPID MAPS
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