In-Silico Structure Database (LMISSD)
Common Name
TG(39:0/38:0/26:2(5E,9Z))
Systematic Name
1-nonatriacontanoyl-2-octatriacontanoyl-3-(5Z,9E-hexacosadienoyl)-sn-glycerol
LM ID
LMGL0301LJEI
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1573.565790
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
YCDIQAZIQILCPH-OPJZQTPPSA-N
InChi (Click to copy)
InChI=1S/C106H204O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-42-44-46-48-50-52-54-55-57-59-61-63-66-69-72-75-78-81-84-87-90-93-96-99-105(108)111-102-103(101-110-104(107)98-95-92-89-86-83-80-77-74-71-68-65-39-36-33-30-27-24-21-18-15-12-9-6-3)112-106(109)100-97-94-91-88-85-82-79-76-73-70-67-64-62-60-58-56-53-51-49-47-45-43-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h74,77,86,89,103H,4-73,75-76,78-85,87-88,90-102H2,1-3H3/b77-74-,89-86+/t103-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCC/C=C/CC/C=C\CCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O