In-Silico Structure Database (LMISSD)
Common Name
TG(20:3(5Z,8Z,11Z)/10:0/15:0)
Systematic Name
1-(5Z,8Z,11Z-eicosatrienoyl)-2-decanoyl-3-pentadecanoyl-sn-glycerol
LM ID
LMGL0301FHJM
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
758.642440
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
RVYXAGXCANQSBQ-ZMMPQAGZSA-N
InChi (Click to copy)
InChI=1S/C48H86O6/c1-4-7-10-13-16-18-20-22-23-24-25-26-28-30-33-35-38-41-47(50)53-44-45(54-48(51)42-39-36-31-15-12-9-6-3)43-52-46(49)40-37-34-32-29-27-21-19-17-14-11-8-5-2/h22-23,25-26,30,33,45H,4-21,24,27-29,31-32,34-44H2,1-3H3/b23-22-,26-25-,33-30-/t45-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O