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CHEBI:186147 - PG(O-16:0/20:4(5Z,8Z,11Z,14Z))

ChEBI IDCHEBI:186147
ChEBI NamePG(O-16:0/20:4(5Z,8Z,11Z,14Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H77O9P
Net Charge0
Average Mass757.043
Monoisotopic Mass756.53052
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C42H77O9P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-42(45)51-41(39-50-52(46,47)49-37-40(44)36-43)38-48-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,26,28,40-41,43-44H,3-10,12,14-16,18,20,23-25,27,29-39H2,1-2H3,(H,46,47)/b13-11-,19-17-,22-21-,28-26-/t40-,41+/m0/s1
InChIKeyFDTWAXVDPVXUJI-BRHHLFQVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PG(O-16:0/20:4(5Z,8Z,11Z,14Z)) (CHEBI:186147) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-hexadecoxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Manual XrefsDatabases
113377718ChemSpider
LMGP04020090LIPID MAPS