In-Silico Structure Database (LMISSD)
Common Name
TG(16:0/15:1(9Z)/26:2(5Z,9Z))
Systematic Name
1-hexadecanoyl-2-(9Z-pentadecenoyl)-3-(5Z,9Z-hexacosadienoyl)-sn-glycerol
LM ID
LMGL0301AHA8
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
926.830240
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
GQHQCMYOLVOTQS-VGXGIDGTSA-N
InChi (Click to copy)
InChI=1S/C60H110O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-33-34-36-39-41-44-47-50-53-59(62)65-56-57(66-60(63)54-51-48-45-42-37-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-38-35-23-20-17-14-11-8-5-2/h18,21,33-34,41,44,57H,4-17,19-20,22-32,35-40,42-43,45-56H2,1-3H3/b21-18-,34-33-,44-41-/t57-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCC/C=C\CC/C=C\CCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCC)=O)COC(CCCCCCCCCCCCCCC)=O