In-Silico Structure Database (LMISSD)
Common Name
TG(18:2(6Z,9Z)/34:0/39:0)
Systematic Name
1-(6Z,9Z-octadecadienoyl)-2-tetratriacontanoyl-3-nonatriacontanoyl-sn-glycerol
LM ID
LMGL0301C354
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1405.377990
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
GOWINWDCLVNAIH-VDIJGEINSA-N
InChi (Click to copy)
InChI=1S/C94H180O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-45-46-47-48-50-51-53-55-57-59-61-63-66-69-72-75-78-81-84-87-93(96)99-90-91(89-98-92(95)86-83-80-77-74-71-68-65-27-24-21-18-15-12-9-6-3)100-94(97)88-85-82-79-76-73-70-67-64-62-60-58-56-54-52-49-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h27,65,71,74,91H,4-26,28-64,66-70,72-73,75-90H2,1-3H3/b65-27-,74-71-/t91-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCC/C=C\C/C=C\CCCCCCCC)=O