In-Silico Structure Database (LMISSD)
Common Name
TG(11:0/17:2(9Z,12Z)/20:4(5Z,8Z,10E,14Z))
Systematic Name
1-undecanoyl-2-(9Z,12Z-heptadecadienoyl)-3-(5Z,8Z,10E,14Z-eicosatetraenoyl)-sn-glycerol
LM ID
LMGL03019GGV
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
794.642440
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
QOILYUYPKWPGPQ-NJDRGZOZSA-N
InChi (Click to copy)
InChI=1S/C51H86O6/c1-4-7-10-13-16-19-21-23-25-26-27-29-30-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-18-15-12-9-6-3)57-51(54)45-42-39-36-33-31-28-24-22-20-17-14-11-8-5-2/h14,16-17,19,22,24-27,29,32,35,48H,4-13,15,18,20-21,23,28,30-31,33-34,36-47H2,1-3H3/b17-14-,19-16-,24-22-,26-25+,29-27-,35-32-/t48-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCC/C=C\C/C=C\C=C\CC/C=C\CCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCCC)=O