In-Silico Structure Database (LMISSD)
Common Name
TG(32:0/22:1(13Z)/36:0)
Systematic Name
1-dotriacontanoyl-2-(13Z-docosenoyl)-3-hexatriacontanoyl-sn-glycerol
LM ID
LMGL0301KGER
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1393.377990
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
UUUPDPYYPKLWOJ-GLGGBYLESA-N
InChi (Click to copy)
InChI=1S/C93H180O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-45-46-47-49-51-53-55-57-60-62-65-68-71-74-77-80-83-86-92(95)98-89-90(99-93(96)87-84-81-78-75-72-69-66-63-58-33-30-27-24-21-18-15-12-9-6-3)88-97-91(94)85-82-79-76-73-70-67-64-61-59-56-54-52-50-48-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h27,30,90H,4-26,28-29,31-89H2,1-3H3/b30-27-/t90-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O