In-Silico Structure Database (LMISSD)
Common Name
TG(32:0/14:1(9Z)/12:0)
Systematic Name
1-dotriacontanoyl-2-(9Z-tetradecenoyl)-3-dodecanoyl-sn-glycerol
LM ID
LMGL0301KC9Y
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
944.877190
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
ADTKRSADFBYKLQ-QFFZNPJISA-N
InChi (Click to copy)
InChI=1S/C61H116O6/c1-4-7-10-13-16-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-18-15-12-9-6-3)67-61(64)55-52-49-46-43-39-20-17-14-11-8-5-2/h14,17,58H,4-13,15-16,18-57H2,1-3H3/b17-14-/t58-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O