In-Silico Structure Database (LMISSD)
Common Name
TG(10:0/18:2(2E,4E)/17:1(9Z))
Systematic Name
1-decanoyl-2-(2E,4E-octadecadienoyl)-3-(9Z-heptadecenoyl)-sn-glycerol
LM ID
LMGL03019BTY
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
758.642440
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
WOBRNMAYQLOPKU-LKQWZNDNSA-N
InChi (Click to copy)
InChI=1S/C48H86O6/c1-4-7-10-13-16-18-20-22-24-26-28-30-33-36-39-42-48(51)54-45(43-52-46(49)40-37-34-31-15-12-9-6-3)44-53-47(50)41-38-35-32-29-27-25-23-21-19-17-14-11-8-5-2/h21,23,33,36,39,42,45H,4-20,22,24-32,34-35,37-38,40-41,43-44H2,1-3H3/b23-21-,36-33+,42-39+/t45-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCC/C=C\CCCCCCC)[C@]([H])(OC(/C=C/C=C/CCCCCCCCCCCCC)=O)COC(CCCCCCCCC)=O