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CHEBI:64396 - 1-oleyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:64396
ChEBI Name1-oleyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-oleyl-sn-glycero-3-phosphocholine
DefinitionA 1-alkyl-sn-glycero-3-phosphocholine in which the alkyl group is specified as oleyl (9Z-octadecenyl).
Last Modified10 March 2017
SubmitterSteve
DownloadsMolfile
FormulaC26H54NO6P
Net Charge0
Average Mass507.693
Monoisotopic Mass507.36888
SMILESCCCCCCCC/C=C\CCCCCCCCOC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C26H54NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h12-13,26,28H,5-11,14-25H2,1-4H3/b13-12-/t26-/m1/s1
InChIKeyXWYSLMAMRKYUFH-HTOVTZSWSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
1-oleyl-sn-glycero-3-phosphocholine (CHEBI:64396) is a 1-alkyl-sn-glycero-3-phosphocholine (CHEBI:30909)
1-oleyl-sn-glycero-3-phosphocholine (CHEBI:64396) is a lysophosphatidylcholine O-18:1 (CHEBI:64591)
IUPAC Name 
(2R)-2-hydroxy-3-[(9Z)-octadec-9-en-1-yloxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-[(9Z)-octadec-9-en-1-yl]-sn-glycero-3-phosphocholineChEBI
PC(O-18:1(9Z)/0:0)LIPID MAPS
1-(9Z-octadecenyl)-sn-glycero-3-phosphocholineLIPID MAPS
lysoPC(O-18:1)ChEBI
(2R)-2-hydroxy-3-[(9Z)-octadec-9-en-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphateIUPAC
UniProt Name  Source
1-O-(9Z-octadecenyl)-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
LMGP01060039LIPID MAPS
Registry NumbersSources
Reaxys:6577609Reaxys