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CHEBI:168533 - PG(12:0/14:1(9Z))

ChEBI IDCHEBI:168533
ChEBI NamePG(12:0/14:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H61O10P
Net Charge0
Average Mass636.804
Monoisotopic Mass636.40023
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)CO
InChIInChI=1S/C32H61O10P/c1-3-5-7-9-11-13-14-16-18-20-22-24-32(36)42-30(28-41-43(37,38)40-26-29(34)25-33)27-39-31(35)23-21-19-17-15-12-10-8-6-4-2/h9,11,29-30,33-34H,3-8,10,12-28H2,1-2H3,(H,37,38)/b11-9-/t29-,30+/m0/s1
InChIKeyWKSCFKDSVLQUGR-UJWMCUGQSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
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)
PG(12:0/14:1(9Z)) (CHEBI:168533) is a phosphatidylglycerol (CHEBI:17517)
IUPAC Name 
[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-dodecanoyloxypropan-2-yl] (Z)-tetradec-9-enoate
Manual XrefsDatabases
LMGP04010046LIPID MAPS