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CHEBI:192344 - PE(P-18:1(9Z)/18:1(9Z))

ChEBI IDCHEBI:192344
ChEBI NamePE(P-18:1(9Z)/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H78NO7P
Net Charge0
Average Mass728.049
Monoisotopic Mass727.55159
SMILESCCCCCCCC/C=C\CCCCCC/C=C\OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C41H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-46-38-40(39-48-50(44,45)47-37-35-42)49-41(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,33,36,40H,3-16,21-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b19-17-,20-18-,36-33-/t40-/m1/s1
InChIKeyCFANDHZPOSNKNO-UDHSZFGOSA-N
Species of MetaboliteComponentSourceComments
Ovis aries (ncbitaxon:9940) Rumen (NCIT:C98778) MetaboLights (MTBLS3683)
ChEBI Ontology
Outgoing Relation(s)
PE(P-18:1(9Z)/18:1(9Z)) (CHEBI:192344) is a glycerophosphoethanolamine (CHEBI:36314)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(1Z,9Z)-octadeca-1,9-dienoxy]propan-2-yl] (Z)-octadec-9-enoate
Manual XrefsDatabases
HMDB0011441HMDB
24769325ChemSpider