CHEBI:90484 - 1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:90484
ChEBI Name1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine
DefinitionA 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine in which the alkyl and the acyl groups at positions 1 and 2 are specified as (1Z)-octadecenyl and (8Z,11Z,14Z)-icosatrienoyl respectively.
Last Modified1 July 2016
Submittermwilliams
DownloadsMolfile
FormulaC43H80NO7P
Net Charge0
Average Mass754.087
Monoisotopic Mass753.56724
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C43H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,35,38,42H,3-10,12,14-16,18,20-21,23,25-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b13-11-,19-17-,24-22-,38-35-/t42-/m1/s1
InChIKeyAFHNYJFSTNQXTK-MTROFRMRSA-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-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:90484) has functional parent all-cis-icosa-8,11,14-trienoic acid (CHEBI:53486)
1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:90484) has role mouse metabolite (CHEBI:75771)
1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:90484) is a 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine (CHEBI:17476)
IUPAC Name 
(17Z,21R)-27-amino-24-hydroxy-24-oxo-19,23,25-trioxa-24λ5-phosphaheptacos-17-en-21-yl (8Z,11Z,14Z)-icosa-8,11,14-trienoate
Synonyms  Source
PE(P-18:0/20:3(8Z,11Z,14Z))LIPID MAPS
PE P-18:0/20:3ChEBI
1-(1Z-octadecenyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-glycero-3-phosphoethanolamineLIPID MAPS
Manual XrefsDatabases
LMGP02030055LIPID MAPS
HMDB0011384HMDB