In-Silico Structure Database (LMISSD)
Common Name
TG(39:0/39:0/32:0)
Systematic Name
1,2-di-nonatriacontanoyl-3-dotriacontanoyl-sn-glycerol
LM ID
LMGL0301LJG1
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1675.706640
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
AMTFUSIECKATIE-PRAWAPJASA-N
InChi (Click to copy)
InChI=1S/C113H222O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-51-53-55-57-59-61-64-67-70-73-76-79-82-85-88-91-94-97-100-103-106-112(115)118-109-110(108-117-111(114)105-102-99-96-93-90-87-84-81-78-75-72-69-66-63-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)119-113(116)107-104-101-98-95-92-89-86-83-80-77-74-71-68-65-62-60-58-56-54-52-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h110H,4-109H2,1-3H3/t110-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O