In-Silico Structure Database (LMISSD)
Common Name
TG(18:0/12:0/18:0)
Systematic Name
1,3-di-octadecanoyl-2-dodecanoyl-sn-glycerol
LM ID
LMGL0301BCUC
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
806.736340
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
PNRYLOWVFBNJBE-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C51H98O6/c1-4-7-10-13-16-19-21-23-25-27-29-32-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-31-18-15-12-9-6-3)47-56-50(53)44-41-38-35-33-30-28-26-24-22-20-17-14-11-8-5-2/h48H,4-47H2,1-3H3
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCC)=O