In-Silico Structure Database (LMISSD)
Common Name
TG(11:0/17:1(9Z)/12:0)
Systematic Name
1-undecanoyl-2-(9Z-heptadecenoyl)-3-dodecanoyl-sn-glycerol
LM ID
LMGL03019GDD
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
692.595490
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
CMXVFLVZXYTJDX-VYOBOKEXSA-N
InChi (Click to copy)
InChI=1S/C43H80O6/c1-4-7-10-13-16-19-20-21-22-23-25-28-31-34-37-43(46)49-40(38-47-41(44)35-32-29-26-18-15-12-9-6-3)39-48-42(45)36-33-30-27-24-17-14-11-8-5-2/h20-21,40H,4-19,22-39H2,1-3H3/b21-20-/t40-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCCCC)=O)COC(CCCCCCCCCC)=O