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CHEBI:84828 - 1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:84828
ChEBI Name1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine
DefinitionA phosphatidylcholine (P-38:4) in which the alkenyl group at position 1 is (1Z)-octadecenyl and the acyl group at position 2 is (5Z,8Z,11Z,14Z)-icosatetraenoyl.
Last Modified5 October 2016
Submitternamrata
DownloadsMolfile
FormulaC46H84NO7P
Net Charge0
Average Mass794.152
Monoisotopic Mass793.59854
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C46H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h14,16,20,22,25,27,31,33,38,41,45H,6-13,15,17-19,21,23-24,26,28-30,32,34-37,39-40,42-44H2,1-5H3/b16-14-,22-20-,27-25-,33-31-,41-38-/t45-/m1/s1
InChIKeyFHHVIBPVBBRLOR-IYACIECVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:84828) has functional parent arachidonic acid (CHEBI:15843)
1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:84828) has role mouse metabolite (CHEBI:75771)
1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:84828) is a 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine (CHEBI:77286)
1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:84828) is a phosphatidylcholine (P-38:4) (CHEBI:85863)
IUPAC Name 
(2R)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-[(1Z)-octadec-1-en-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate
Synonyms  Source
PC(P-18:0/20:4(5Z,8Z,11Z,14Z))LIPID MAPS
PC(P-18:0/20:4)LIPID MAPS
1-[(1Z)-octadecenyl]-2-[(5Z,8Z,11Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholineChEBI
GPC(P-18:0/20:4)ChEBI
1-(1-enyl-stearoyl)-2-arachidonoyl-GPCChEBI
1-[(1Z)-octadecenyl]-2-arachidonoyl-sn-glycero-3-phosphocholineChEBI
Manual XrefsDatabases
LMGP01030012LIPID MAPS
HMDB0011253HMDB