In-Silico Structure Database (LMISSD)
Common Name
TG(17:2(9Z,12Z)/17:2(9Z,12Z)/36:0)
Systematic Name
1,2-di-(9Z,12Z-heptadecadienoyl)-3-hexatriacontanoyl-sn-glycerol
LM ID
LMGL0301A795
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1107.018040
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
YOEDRKFDONWMOK-CLNYQKALSA-N
InChi (Click to copy)
InChI=1S/C73H134O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-49-51-54-57-60-63-66-72(75)78-69-70(79-73(76)67-64-61-58-55-52-48-27-24-21-18-15-12-9-6-3)68-77-71(74)65-62-59-56-53-50-47-26-23-20-17-14-11-8-5-2/h14-15,17-18,23-24,26-27,70H,4-13,16,19-22,25,28-69H2,1-3H3/b17-14-,18-15-,26-23-,27-24-/t70-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCC/C=C\C/C=C\CCCC)=O