In-Silico Structure Database (LMISSD)
Common Name
TG(14:0/38:0/36:0)
Systematic Name
1-tetradecanoyl-2-octatriacontanoyl-3-hexatriacontanoyl-sn-glycerol
LM ID
LMGL030190SO
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1367.362340
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
YUNKBCUIFXJZNB-ZGADVIBFSA-N
InChi (Click to copy)
InChI=1S/C91H178O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-40-42-44-45-47-49-51-53-55-57-59-61-63-65-67-70-73-76-79-82-85-91(94)97-88(86-95-89(92)83-80-77-74-71-68-21-18-15-12-9-6-3)87-96-90(93)84-81-78-75-72-69-66-64-62-60-58-56-54-52-50-48-46-43-41-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h88H,4-87H2,1-3H3/t88-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCC)=O