In-Silico Structure Database (LMISSD)
Common Name
MGDG(12:0/20:1(11E))
Systematic Name
1-dodecanoyl,2-(11E-eicosenoyl)-3-3-O-β-D-galactosyl-sn-glycerol
LM ID
LMGL05019AFW
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
728.543850
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
URAAZHDCUFBLOF-YLURKWHLSA-N
InChi (Click to copy)
InChI=1S/C41H76O10/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-30-37(44)50-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)32-48-36(43)29-27-25-23-21-12-10-8-6-4-2/h15-16,34-35,38-42,45-47H,3-14,17-33H2,1-2H3/b16-15+/t34-,35-,38+,39?,40?,41-/m1/s1
SMILES (Click to copy)
C(O[C@@H]1O[C@H](CO)[C@H](O)C(O)C1O)[C@]([H])(OC(CCCCCCCCC/C=C/CCCCCCCC)=O)COC(CCCCCCCCCCC)=O