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CHEBI:187557 - PA(O-16:0/12:0)

ChEBI IDCHEBI:187557
ChEBI NamePA(O-16:0/12:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H63O7P
Net Charge0
Average Mass578.812
Monoisotopic Mass578.43114
SMILESCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCC
InChIInChI=1S/C31H63O7P/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-27-36-28-30(29-37-39(33,34)35)38-31(32)26-24-22-20-18-12-10-8-6-4-2/h30H,3-29H2,1-2H3,(H2,33,34,35)/t30-/m1/s1
InChIKeyXKILFGZWURXBMZ-SSEXGKCCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
PA(O-16:0/12:0) (CHEBI:187557) is a ether lipid (CHEBI:64611)
PA(O-16:0/12:0) (CHEBI:187557) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name 
[(2R)-1-hexadecoxy-3-phosphonooxypropan-2-yl] dodecanoate
Manual XrefsDatabases
LMGP10020002LIPID MAPS
113379315ChemSpider