EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:53759 - trielaidin

ChEBI IDCHEBI:53759
ChEBI Nametrielaidin
Stars
DefinitionA triglyceride formed by esterification of the three hydroxy groups of glycerol with elaidic acid.
Last Modified7 December 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC57H104O6
Net Charge0
Average Mass885.453
Monoisotopic Mass884.78329
SMILESCCCCCCCC/C=C/CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)OC(=O)CCCCCCC/C=C/CCCCCCCC
InChIInChI=1S/C57H104O6/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/h25-30,54H,4-24,31-53H2,1-3H3/b28-25+,29-26+,30-27+
InChIKeyPHYFQTYBJUILEZ-WUOFIQDXSA-N
ChEBI Ontology
Outgoing Relation(s)
trielaidin (CHEBI:53759) has functional parent elaidic acid (CHEBI:27997)
trielaidin (CHEBI:53759) is a triglyceride (CHEBI:17855)
IUPAC Name 
propane-1,2,3-triyl tris[(9E)-octadec-9-enoate]
Synonyms  Source
propane-1,2,3-triyl (9E,9'E,9''E)tris-octadec-9-enoateIUPAC
Glycerol trielaidateChemIDplus
TrielaidoylglycerolChemIDplus
(E,E,E)-9-Octadecenoic acid, 1,2,3-propanetriyl esterNIST Chemistry WebBook
(9E,9'E,9''E)-9-Octadecenoic acid, 1,2,3-propanetriyl esterChemIDplus
Registry NumbersSources
Beilstein:1718693Beilstein
CAS:537-39-3ChemIDplus
CAS:537-39-3NIST Chemistry WebBook