EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78813 - 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion

ChEBI IDCHEBI:78813
ChEBI Name1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion
Stars
ASCII Name1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion
DefinitionA phosphatidylethanolamine 34:1 obtained by transfer of a proton from the amino to the phosphate group of 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine; major species at pH 7.3.
Last Modified12 January 2015
Submitternhn
DownloadsMolfile
FormulaC39H76NO8P
Net Charge0
Average Mass718.010
Monoisotopic Mass717.53086
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1
InChIKeyDVXMEPWDARXHCX-OTMQOFQLSA-N
ChEBI Ontology
Outgoing Relation(s)
1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78813) is a phosphatidylethanolamine 34:1 zwitterion (CHEBI:71720)
1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78813) is tautomer of 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine (CHEBI:82839)
Incoming Relation(s)
1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine (CHEBI:82839) is tautomer of 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78813)
IUPAC Name 
2-azaniumylethyl (2R)-2-(hexadecanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propyl phosphate
Synonyms  Source
1-(9Z)-octadecenoyl-2-hexadecanoyl-sn-glycero-3-phosphoethanolamine zwitterionSUBMITTER
2-azaniumylethyl (2R)-3-[(9Z)-octadec-9-enoyloxy]-2-(palmitoyloxy)propyl phosphateIUPAC
UniProt Name  Source
1-(9Z-octadecenoyl)-2-hexadecanoyl-sn-glycero-3-phosphoethanolamineUniProt
Citations