In-Silico Structure Database (LMISSD)
Common Name
TG(37:0/18:4(6Z,9Z,12Z,15Z)/37:0)
Systematic Name
1,3-di-heptatriacontanoyl-2-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycerol
LM ID
LMGL0301K5M6
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1415.362340
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
BQMAXAJFSXSEOI-QKBLYJTOSA-N
InChi (Click to copy)
InChI=1S/C95H178O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-46-48-50-52-54-56-58-60-62-64-67-69-72-75-78-81-84-87-93(96)99-90-92(101-95(98)89-86-83-80-77-74-71-66-27-24-21-18-15-12-9-6-3)91-100-94(97)88-85-82-79-76-73-70-68-65-63-61-59-57-55-53-51-49-47-45-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h9,12,18,21,27,66,74,77,92H,4-8,10-11,13-17,19-20,22-26,28-65,67-73,75-76,78-91H2,1-3H3/b12-9-,21-18-,66-27-,77-74-
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O