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CHEBI:187515 - PG(O-20:0/18:4(6Z,9Z,12Z,15Z))

ChEBI IDCHEBI:187515
ChEBI NamePG(O-20:0/18:4(6Z,9Z,12Z,15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H81O9P
Net Charge0
Average Mass785.097
Monoisotopic Mass784.56182
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C44H81O9P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-37-50-40-43(41-52-54(48,49)51-39-42(46)38-45)53-44(47)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,22,26,28,42-43,45-46H,3-5,7,9-11,13,15-17,19-21,23-25,27,29-41H2,1-2H3,(H,48,49)/b8-6-,14-12-,22-18-,28-26-/t42-,43+/m0/s1
InChIKeySFECMQWOFVWTKY-MKULVAFASA-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-20:0/18:4(6Z,9Z,12Z,15Z)) (CHEBI:187515) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-icosoxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
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113377686ChemSpider
LMGP04020056LIPID MAPS