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CHEBI:75844 - 1,2,3-trilinoleoylglycerol

Default Structure
ChEBI IDCHEBI:75844
ChEBI Name1,2,3-trilinoleoylglycerol
Stars
DefinitionA triglyceride formed by acylation of the three hydroxy groups of glycerol with linoleic acid.
Last Modified31 May 2018
Submitterlaimo
DownloadsMolfile
FormulaC57H98O6
Net Charge0
Average Mass879.405
Monoisotopic Mass878.73634
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-
InChIKeyHBOQXIRUPVQLKX-BBWANDEASA-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)
1,2,3-trilinoleoylglycerol (CHEBI:75844) has functional parent linoleic acid (CHEBI:17351)
1,2,3-trilinoleoylglycerol (CHEBI:75844) has role mouse metabolite (CHEBI:75771)
1,2,3-trilinoleoylglycerol (CHEBI:75844) is a 1,2-diacyl-3-linoleoylglycerol (CHEBI:228231)
1,2,3-trilinoleoylglycerol (CHEBI:75844) is a 1,3-diacyl-2-linoleoylglycerol (CHEBI:228232)
1,2,3-trilinoleoylglycerol (CHEBI:75844) is a linoleoyl containing 1,2,3-triacyl-sn-glycerol (CHEBI:144774)
1,2,3-trilinoleoylglycerol (CHEBI:75844) is a TG(18:2/18:2/18:2) (CHEBI:140883)
1,2,3-trilinoleoylglycerol (CHEBI:75844) is a triglyceride (CHEBI:17855)
IUPAC Name 
propane-1,2,3-triyl (9Z,12Z,9'Z,12'Z,9''Z,12''Z)tris-octadeca-9,12-dienoate
Synonyms  Source
1,2,3-Propanetriol trilinoleateChemIDplus
1,2,3-Propenetriol tri(9,12-octadecadienoate)ChemIDplus
1,2,3-tri-(9Z,12Z-octadecadienoyl)glycerolLIPID MAPS
Glyceryl trilinoleateChemIDplus
linoleoyl triglycerideSUBMITTER
TAG(18:2/18:2/18:2)HMDB
UniProt Name  Source
1,2,3-tri-(9Z,12Z)-octadecadienoylglycerolUniProt
Manual XrefsDatabases
HMDB0005474HMDB
LMGL03010371LIPID MAPS
Registry NumbersSources
Reaxys:1718698Reaxys
CAS:537-40-6ChemIDplus