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CHEBI:187769 - PE(O-20:0/12:0)

ChEBI IDCHEBI:187769
ChEBI NamePE(O-20:0/12:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H76NO7P
Net Charge0
Average Mass677.989
Monoisotopic Mass677.53594
SMILESCCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCC
InChIInChI=1S/C37H76NO7P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-32-42-34-36(35-44-46(40,41)43-33-31-38)45-37(39)30-28-26-24-22-12-10-8-6-4-2/h36H,3-35,38H2,1-2H3,(H,40,41)/t36-/m1/s1
InChIKeyWMSDVPFHOFGIJT-PSXMRANNSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PE(O-20:0/12:0) (CHEBI:187769) is a alkylacylglycerophosphoethanolamine (CHEBI:52578)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-icosoxypropan-2-yl] dodecanoate
Manual XrefsDatabases
113375940ChemSpider
LMGP02020061LIPID MAPS