In-Silico Structure Database (LMISSD)
Common Name
TG(P-20:1(9Z)/14:1(9Z)/15:1(9Z))
Systematic Name
1-(1Z,9Z-eicosadienyl)-2-(9Z-tetradecenoyl)-3-(9Z-pentadecenoyl)-sn-glycerol
LM ID
LMGL0304AM71
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
798.710125
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
1Z-alkenyldiacylglycerols [GL0304]
String Representations
InChiKey (Click to copy)
VHCNUWSNDANRCL-VIKMTBIVSA-N
InChi (Click to copy)
InChI=1S/C52H94O5/c1-4-7-10-13-16-19-22-24-25-26-27-28-29-32-35-38-41-44-47-55-48-50(57-52(54)46-43-40-37-34-30-21-18-15-12-9-6-3)49-56-51(53)45-42-39-36-33-31-23-20-17-14-11-8-5-2/h15,17-18,20,26-27,44,47,50H,4-14,16,19,21-25,28-43,45-46,48-49H2,1-3H3/b18-15-,20-17-,27-26-,47-44-/t50-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCC/C=C\CCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCCCC