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CHEBI:147311 - 1,2,3-tricervonoylglycerol

Default Structure
ChEBI IDCHEBI:147311
ChEBI Name1,2,3-tricervonoylglycerol
Stars
Last Modified6 August 2020
Submitterlaimo
DownloadsMolfile
FormulaC69H98O6
Net Charge0
Average Mass1023.537
Monoisotopic Mass1022.73634
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OCC(COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C69H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,34-39,43-48,52-57,66H,4-6,13-15,22-24,31-33,40-42,49-51,58-65H2,1-3H3/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,37-34-,38-35-,39-36-,46-43-,47-44-,48-45-,55-52-,56-53-,57-54-
InChIKeySOFMPBOQLPVEQZ-LBUXZKOBSA-N
ChEBI Ontology
Outgoing Relation(s)
1,2,3-tricervonoylglycerol (CHEBI:147311) has functional parent (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate (CHEBI:77016)
1,2,3-tricervonoylglycerol (CHEBI:147311) is a triglyceride (CHEBI:17855)
Synonyms  Source
TAG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))SUBMITTER
TAG(22:6n3/22:6n3/22:6n3)SUBMITTER
UniProt Name  Source
1,2,3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerolUniProt
Manual XrefsDatabases
HMDB0010562HMDB
LMGL03012611LIPID MAPS
Citations