In-Silico Structure Database (LMISSD)
Common Name
DG(12:0/20:4(7E,10E,13E,16E)/0:0)
Systematic Name
1-dodecanoyl-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycerol
LM ID
LMGL02019AF9
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
560.444075
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Diradylglycerols [GL02]
Diacylglycerols [GL0201]
String Representations
InChiKey (Click to copy)
CPYAQJPVAQVYAM-MJFAHVLZSA-N
InChi (Click to copy)
InChI=1S/C35H60O5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-30-35(38)40-33(31-36)32-39-34(37)29-27-25-23-21-12-10-8-6-4-2/h7,9,13-14,16-17,19-20,33,36H,3-6,8,10-12,15,18,21-32H2,1-2H3/b9-7+,14-13+,17-16+,20-19+/t33-/m0/s1
SMILES (Click to copy)
OC[C@]([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)COC(CCCCCCCCCCC)=O