In-Silico Structure Database (LMISSD)
Common Name
MGDG(26:2(5Z,9Z)/32:0)
Systematic Name
1-(5Z,9Z-hexacosadienoyl),2-dotriacontanoyl-3-3-O-β-D-galactosyl-sn-glycerol
LM ID
LMGL05019ERG
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1090.935100
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
ASHIBYVDWUNXCY-WXWFNRJXSA-N
InChi (Click to copy)
InChI=1S/C67H126O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-31-32-34-36-38-40-42-44-46-48-50-52-54-56-63(70)76-60(59-75-67-66(73)65(72)64(71)61(57-68)77-67)58-74-62(69)55-53-51-49-47-45-43-41-39-37-35-33-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,41,47,49,60-61,64-68,71-73H,3-38,40,42-46,48,50-59H2,1-2H3/b41-39-,49-47-/t60-,61-,64+,65?,66?,67-/m1/s1
SMILES (Click to copy)
C(O[C@@H]1O[C@H](CO)[C@H](O)C(O)C1O)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCC/C=C\CC/C=C\CCCCCCCCCCCCCCCC)=O