In-Silico Structure Database (LMISSD)
Common Name
MGDG(14:1(9Z)/18:1(4E))
Systematic Name
1-(9Z-tetradecenoyl),2-(4E-octadecenoyl)-3-3-O-β-D-galactosyl-sn-glycerol
LM ID
LMGL05019AMC
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
726.528200
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
MBUJEJPXBNZCNK-XFAIUVHMSA-N
InChi (Click to copy)
InChI=1S/C41H74O10/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-37(44)50-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)32-48-36(43)29-27-25-23-21-19-14-12-10-8-6-4-2/h10,12,24,26,34-35,38-42,45-47H,3-9,11,13-23,25,27-33H2,1-2H3/b12-10-,26-24+/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(CC/C=C/CCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCC)=O