In-Silico Structure Database (LMISSD)
Common Name
TG(10:0/17:1(9Z)/18:2(9E,11E))
Systematic Name
1-decanoyl-2-(9Z-heptadecenoyl)-3-(9E,11E-octadecadienoyl)-sn-glycerol
LM ID
LMGL03019A2O
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)
SMAYDNOJGFZLMI-PTWHFWQXSA-N
InChi (Click to copy)
InChI=1S/C48H86O6/c1-4-7-10-13-16-18-20-22-24-26-27-29-32-35-38-41-47(50)53-44-45(43-52-46(49)40-37-34-31-15-12-9-6-3)54-48(51)42-39-36-33-30-28-25-23-21-19-17-14-11-8-5-2/h18,20-24,45H,4-17,19,25-44H2,1-3H3/b20-18+,23-21-,24-22+/t45-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCC/C=C/C=C/CCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCCCC)=O)COC(CCCCCCCCC)=O