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CHEBI:176741 - PE(18:2/18:3)

ChEBI IDCHEBI:176741
ChEBI NamePE(18:2/18:3)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H72NO8P
Net Charge0
Average Mass738.000
Monoisotopic Mass737.49955
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C41H72NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,17-20,24,26,39H,3-5,7,9-11,13,15-16,21-23,25,27-38,42H2,1-2H3,(H,45,46)/b8-6-,14-12-,19-17-,20-18-,26-24-/t39-/m1/s1
InChIKeyUMXDTECRBMWOSU-GPWDKVOISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
ChEBI Ontology
Outgoing Relation(s)
PE(18:2/18:3) (CHEBI:176741) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] (Z)-octadec-9-enoate
Manual XrefsDatabases
24768531ChemSpider
LMGP02010644LIPID MAPS
HMDB0009063HMDB