In-Silico Structure Database (LMISSD)
Common Name
TG(20:3(5Z,8Z,11Z)/24:0/13:0)
Systematic Name
1-(5Z,8Z,11Z-eicosatrienoyl)-2-tetracosanoyl-3-tridecanoyl-sn-glycerol
LM ID
LMGL0301FLF6
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
926.830240
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
DUVAPQKDILYPAH-ZBDXMTHHSA-N
InChi (Click to copy)
InChI=1S/C60H110O6/c1-4-7-10-13-16-19-22-24-26-28-29-30-31-33-35-37-39-42-45-48-51-54-60(63)66-57(55-64-58(61)52-49-46-43-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-34-32-27-25-23-20-17-14-11-8-5-2/h25,27,34,36,41,44,57H,4-24,26,28-33,35,37-40,42-43,45-56H2,1-3H3/b27-25-,36-34-,44-41-/t57-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O