Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 02:28:39 UTC
Update Date2022-08-31 18:50:36 UTC
Metabolite IDMMDBc0032731
Metabolite Identification
Common NameDG(18:1(9Z)/12:0(3-OH)/0:0)
DescriptionDG(18:1(9Z)/12:0(3-OH)/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(18:1(9Z)/12:0(3-OH)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
Structure
SynonymsNot Available
Molecular FormulaC33H62O6
Average Mass554.853
Monoisotopic Mass554.454639716
IUPAC Name(2S)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl (9Z)-octadec-9-enoate
Traditional Name(2S)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl (9Z)-octadec-9-enoate
CAS Registry NumberNot Available
SMILES
[H][C@](O)(COC(=O)CCCCCCC\C=C/CCCCCCCC)COC(=O)CC(O)CCCCCCCCC
InChI Identifier
InChI=1S/C33H62O6/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-32(36)38-28-31(35)29-39-33(37)27-30(34)25-23-21-19-10-8-6-4-2/h14-15,30-31,34-35H,3-13,16-29H2,1-2H3/b15-14-/t30?,31-/m0/s1
InChI KeyBPODHYBQHQVWEP-RKOAHRITSA-N