In-Silico Structure Database (LMISSD)
Common Name
DGDG(26:2(5E,9Z)/20:4(5Z,8Z,10E,14Z))
Systematic Name
1-(5Z,9E-hexacosadienoyl),2-(5Z,8Z,10E,14Z-eicosatetraenoyl)-3-3-O-(6'-O-α-D-galactosyl-β-D-galactosyl)-sn-glycerol
LM ID
LMGL05019JXD
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1076.737525
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
SMZUVAJXMUFDLX-DBLHEOABSA-N
InChi (Click to copy)
InChI=1S/C61H104O15/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-29-31-33-35-37-39-41-43-52(63)71-46-49(74-53(64)44-42-40-38-36-34-32-30-27-20-18-16-14-12-10-8-6-4-2)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/h12,14,20,27-30,32,35-38,49-51,54-62,65-70H,3-11,13,15-19,21-26,31,33-34,39-48H2,1-2H3/b14-12-,27-20+,29-28-,32-30-,37-35+,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\C/C=C\C=C\CC/C=C\CCCCC)=O)COC(CCC/C=C/CC/C=C\CCCCCCCCCCCCCCCC)=O