In-Silico Structure Database (LMISSD)
Common Name
DGDG(20:1(13Z)/26:2(5Z,9E))
Systematic Name
1-(13Z-eicosenoyl),2-(5Z,9E-hexacosadienoyl)-3-3-O-(6'-O-α-D-galactosyl-β-D-galactosyl)-sn-glycerol
LM ID
LMGL05019H5G
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1082.784475
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
YMPZKTKRKBJYMF-ZUZXLBPESA-N
InChi (Click to copy)
InChI=1S/C61H110O15/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-42-44-53(64)74-49(46-71-52(63)43-41-39-37-35-33-31-29-27-20-18-16-14-12-10-8-6-4-2)47-72-60-59(70)57(68)55(66)51(76-60)48-73-61-58(69)56(67)54(65)50(45-62)75-61/h14,16,28,30,36,38,49-51,54-62,65-70H,3-13,15,17-27,29,31-35,37,39-48H2,1-2H3/b16-14-,30-28+,38-36-/t49-,50-,51-,54+,55+,56?,57?,58?,59?,60-,61-/m1/s1
SMILES (Click to copy)
C(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)C(O)C2O)[C@H](O)C(O)C1O)[C@]([H])(OC(CCC/C=C\CC/C=C/CCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCC/C=C\CCCCCC)=O