In-Silico Structure Database (LMISSD)
Common Name
TG(10:0/13:0/31:0)
Systematic Name
1-decanoyl-2-tridecanoyl-3-hentriacontanoyl-sn-glycerol
LM ID
LMGL03019AI9
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
890.830240
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
IUOLCAVSBABURX-AXAMJWTMSA-N
InChi (Click to copy)
InChI=1S/C57H110O6/c1-4-7-10-13-16-18-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-15-12-9-6-3)63-57(60)51-48-45-42-38-19-17-14-11-8-5-2/h54H,4-53H2,1-3H3/t54-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCC)=O)COC(CCCCCCCCC)=O