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CHEBI:86173 - 1-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:86173
ChEBI Name1-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine
DefinitionA phosphatidylcholine 38:1 in which the acyl groups specified at positions 1 and 2 are octadecanoyl and (11Z)-eicosenoyl respectively.
Last Modified25 June 2015
Submitternamrata
DownloadsMolfile
FormulaC46H90NO8P
Net Charge0
Average Mass816.199
Monoisotopic Mass815.64041
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C46H90NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h20,22,44H,6-19,21,23-43H2,1-5H3/b22-20-/t44-/m1/s1
InChIKeyPDGHHNMEFVJAAM-UQBBPPAYSA-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-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86173) has functional parent (11Z)-icos-11-enoic acid (CHEBI:32425)
1-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86173) has functional parent octadecanoic acid (CHEBI:28842)
1-octadecanoyl-2-[(11Z)-eicosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86173) is a phosphatidylcholine 38:1 (CHEBI:66860)
IUPAC Name 
(2R)-2-{[(11Z)-icos-11-enoyl]oxy}-3-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
PC(18:0/20:1(11Z))LIPID MAPS
GPCho(18:0/20:1)ChEBI
GPCho(18:0/20:1n9)ChEBI
1-Stearoyl-2-eicosenoyl-sn-glycero-3-phosphocholineChEBI
Phosphatidylcholine(18:0/20:1)ChEBI
Phosphatidylcholine(18:0/20:1w9)ChEBI
Manual XrefsDatabases
LMGP01010783LIPID MAPS
HMDB0008044HMDB