CHEBI:178427 - DG(22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z)/0:0)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name DG(22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z)/0:0)
ChEBI ID CHEBI:178427
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C45H76O5
Net Charge 0
Average Mass 697.098
Monoisotopic Mass 696.56928
InChI InChI=1S/C45H76O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-44(47)49-42-43(41-46)50-45(48)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,22,24,27,29,43,46H,3-10,15-16,21,23,25-26,28,30-42H2,1-2H3/b13-11-,14-12-,19-17-,20-18-,24-22-,29-27-/t43-/m0/s1
InChIKey VECKEBHJYOVSDY-XOAJDLJMSA-N
SMILES O(C(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)CO
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
(via diglyceride )
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via diglyceride )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing DG(22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z)/0:0) (CHEBI:178427) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name
[(2S)-3-hydroxy-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxypropyl] (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
Manual Xrefs Databases
24766353 ChemSpider
HMDB0007689 HMDB
View more database links