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CHEBI:183214 - PE(18:2(9Z,12Z)/P-18:1(9Z))

ChEBI IDCHEBI:183214
ChEBI NamePE(18:2(9Z,12Z)/P-18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H76NO7P
Net Charge0
Average Mass726.033
Monoisotopic Mass725.53594
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)O/C=C\CCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C41H76NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-46-40(39-49-50(44,45)48-37-35-42)38-47-41(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,33,36,40H,3-11,13,15-16,21-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b14-12-,19-17-,20-18-,36-33-/t40-/m1/s1
InChIKeyPCRXUPNJCXVABN-MFTBTGPPSA-N
Species of MetaboliteComponentSourceComments
Trypanosoma brucei (ncbitaxon:5691) cell culture (BTO:0000214) MetaboLights (MTBLS2559)
ChEBI Ontology
Outgoing Relation(s)
PE(18:2(9Z,12Z)/P-18:1(9Z)) (CHEBI:183214) is a glycerophosphoethanolamine (CHEBI:36314)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(1Z,9Z)-octadeca-1,9-dienoxy]propyl] (9Z,12Z)-octadeca-9,12-dienoate
Manual XrefsDatabases
24768580ChemSpider
HMDB0009117HMDB