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CHEBI:191319 - 18:2-18:3-PE

ChEBI IDCHEBI:191319
ChEBI Name18:2-18:3-PE
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H72NO8P
Net Charge0
Average Mass738.000
Monoisotopic Mass737.49955
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[NH3+]
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/h6,8,11-14,17-20,39H,3-5,7,9-10,15-16,21-38,42H2,1-2H3,(H,45,46)/b8-6-,13-11-,14-12-,19-17-,20-18-/t39-/m1/s1
InChIKeyZOXULAUECYWFFP-PDLBZXEASA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
18:2-18:3-PE (CHEBI:191319) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
2-azaniumylethyl [(2R)-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] phosphate
Manual XrefsDatabases
24768558ChemSpider
HMDB0009095HMDB