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CHEBI:84535 - 1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:84535
ChEBI Name1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine
DefinitionA 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine in which the alkyl and the acyl groups at positions 1 and 2 are specified as eicosyl and linolenyl respectively.
Last Modified3 February 2015
Submitternamrata
DownloadsMolfile
FormulaC43H84NO7P
Net Charge0
Average Mass758.119
Monoisotopic Mass757.59854
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C43H84NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-38-48-40-42(41-50-52(46,47)49-39-37-44)51-43(45)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h12,14,18,22,42H,3-11,13,15-17,19-21,23-41,44H2,1-2H3,(H,46,47)/b14-12-,22-18-/t42-/m1/s1
InChIKeyFUOWNRULQZKEKD-VSMMPPDLSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine (CHEBI:84535) has functional parent linoleic acid (CHEBI:17351)
1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine (CHEBI:84535) has role mouse metabolite (CHEBI:75771)
1-eicosyl-2-linolenyl-sn-glycero-3-phosphoethanolamine (CHEBI:84535) is a 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine (CHEBI:36712)
IUPAC Name 
(23R)-29-amino-26-hydroxy-26-oxido-21,25,27-trioxa-26λ5-phosphanonacosan-23-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
1-eicosyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamineChEBI
PE(O-20:0/18:2(9Z,12Z))LIPID MAPS
PE(O-20:0/18:2)LIPID MAPS
Manual XrefsDatabases
LMGP02020073LIPID MAPS