Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-19 13:26:22 UTC
Update Date2022-09-01 00:28:32 UTC
Metabolite IDMMDBc0044967
Metabolite Identification
Common NameDG(20:1(13Z)/28:1(11Z)/0:0)
DescriptionDG(20:1(13Z)/28:1(11Z)/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(20:1(13Z)/28:1(11Z)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
Structure
SynonymsNot Available
Molecular FormulaC51H96O5
Average Mass789.324
Monoisotopic Mass788.725776191
IUPAC Name(2R)-1-hydroxy-3-[(13Z)-icos-13-enoyloxy]propan-2-yl (12Z)-octacos-12-enoate
Traditional Name(2R)-1-hydroxy-3-[(13Z)-icos-13-enoyloxy]propan-2-yl (12Z)-octacos-12-enoate
CAS Registry NumberNot Available
SMILES
[H][C@@](CO)(COC(=O)CCCCCCCCCCC\C=C/CCCCCC)OC(=O)CCCCCCCCCC\C=C/CCCCCCCCCCCCCCC
InChI Identifier
InChI=1S/C51H96O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-51(54)56-49(47-52)48-55-50(53)45-43-41-39-37-35-33-31-29-20-18-16-14-12-10-8-6-4-2/h14,16,26-27,49,52H,3-13,15,17-25,28-48H2,1-2H3/b16-14-,27-26-/t49-/m1/s1
InChI KeyZGYICHKQJHTWFK-OQPZLNJYSA-N