In-Silico Structure Database (LMISSD)
Common Name
TG(P-20:0/16:1(7Z)/12:0)
Systematic Name
1-(1Z-eicosenyl)-2-(7Z-hexadecenoyl)-3-dodecanoyl-sn-glycerol
LM ID
LMGL0304ACUE
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
788.725775
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
1Z-alkenyldiacylglycerols [GL0304]
String Representations
InChiKey (Click to copy)
KWHBFOQXBQCNFV-UBCLXIJOSA-N
InChi (Click to copy)
InChI=1S/C51H96O5/c1-4-7-10-13-16-19-21-23-24-25-26-27-29-31-34-37-40-43-46-54-47-49(48-55-50(52)44-41-38-35-32-18-15-12-9-6-3)56-51(53)45-42-39-36-33-30-28-22-20-17-14-11-8-5-2/h28,30,43,46,49H,4-27,29,31-42,44-45,47-48H2,1-3H3/b30-28-,46-43-/t49-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)CO/C=C\CCCCCCCCCCCCCCCCCC