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CHEBI:176715 - (2R)-1-(Docosanoyloxy)-3-(phosphonooxy)-2-propanyl tetracosanoate

ChEBI IDCHEBI:176715
ChEBI Name(2R)-1-(Docosanoyloxy)-3-(phosphonooxy)-2-propanyl tetracosanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC49H97O8P
Net Charge0
Average Mass845.281
Monoisotopic Mass844.69211
SMILESCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C49H97O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-49(51)57-47(46-56-58(52,53)54)45-55-48(50)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h47H,3-46H2,1-2H3,(H2,52,53,54)/t47-/m1/s1
InChIKeyQWARQXXWLDKQIC-QZNUWAOFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
(2R)-1-(Docosanoyloxy)-3-(phosphonooxy)-2-propanyl tetracosanoate (CHEBI:176715) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-docosanoyloxy-3-phosphonooxypropan-2-yl] tetracosanoate
Manual XrefsDatabases
74877007ChemSpider
HMDB0115267HMDB