In-Silico Structure Database (LMISSD)
Common Name
TG(23:0/27:0/39:0)
Systematic Name
1-tricosanoyl-2-heptacosanoyl-3-nonatriacontanoyl-sn-glycerol
LM ID
LMGL0301H9RM
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1381.377990
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
YGKOONYKGOIBQG-DPBVQAHGSA-N
InChi (Click to copy)
InChI=1S/C92H180O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-39-41-42-43-44-45-46-47-48-49-50-51-52-54-55-58-61-64-67-70-73-76-79-82-85-91(94)97-88-89(87-96-90(93)84-81-78-75-72-69-66-63-60-57-36-33-30-27-24-21-18-15-12-9-6-3)98-92(95)86-83-80-77-74-71-68-65-62-59-56-53-40-38-35-32-29-26-23-20-17-14-11-8-5-2/h89H,4-88H2,1-3H3/t89-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCC)=O