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CHEBI:85076 - 1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:85076
ChEBI Name1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the acyl substituents at positions 1 and 2 are specified as oleoyl and stearoyl respectively.
Last Modified3 March 2015
SubmitterSteve
DownloadsMolfile
FormulaC41H80NO8P
Net Charge0
Average Mass746.064
Monoisotopic Mass745.56216
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C41H80NO8P/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/h17,19,39H,3-16,18,20-38,42H2,1-2H3,(H,45,46)/b19-17-/t39-/m1/s1
InChIKeyLICSIKXBSOVGBP-VEAYGOGPSA-N
ChEBI Ontology
Outgoing Relation(s)
1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85076) has functional parent octadecanoic acid (CHEBI:28842)
1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85076) has functional parent oleic acid (CHEBI:16196)
1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85076) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85076) is tautomer of 1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:84234)
Incoming Relation(s)
1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:84234) is tautomer of 1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85076)
IUPAC Name 
(2R)-3-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(octadecanoyloxy)propyl (9Z)-octadec-9-enoate
Synonyms  Source
1-(9Z-octadecenoyl)-2-octadecanoyl-sn-glycero-3-phosphoethanolamineChEBI
PE(18:1/18:0)LIPID MAPS
PE(18:1(9Z)/18:0)LIPID MAPS
1-(9Z-octadecenoyl)-2-octadecanoyl-sn-glycero-3-phosphoethanolamineLIPID MAPS
PE(36:1)HMDB
Phosphatidylethanolamine(18:1w9/18:0)HMDB
Manual XrefsDatabases
LMGP02010050LIPID MAPS
HMDB0009057HMDB
Registry NumbersSources
Reaxys:6129369Reaxys