In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGL05019AAU
Common NameMGDG(10:0/18:1(6Z))
Systematic Name1-decanoyl,2-(6Z-octadecenoyl)-3-3-O-β-D-galactosyl-sn-glycerol
SynonymsMGDG(28:1); MGDG(10:0_18:1)
Exact Mass
672.4813 (neutral)    Calculate m/z:
FormulaC37H68O10
CategoryGlycerolipids [GL]
Main ClassGlycosyldiradylglycerols [GL05]
Sub ClassGlycosyldiacylglycerols [GL0501]
PubChem Compound ID (CID)-
InChIKeyYMZDGPMCGFWLEI-HKILYABRSA-N
InChIInChI=1S/C37H68O10/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-33(40)46-30(28
-44-32(39)25-23-21-19-10-8-6-4-2)29-45-37-36(43)35(42)34(41)31(27-38)47-37/h17-1
8,30-31,34-38,41-43H,3-16,19-29H2,1-2H3/b18-17-/t30-,31-,34+,35?,36?,37-/m1/s1
SMILESC(O[C@@H]1O[C@H](CO)[C@H](O)C(O)C1O)[C@]([H])(OC(CCCC/C=C\CCCCCCCCCCC)=O)COC(CCC
CCCCCC)=O
MS Spectra-     
StatusActive (generated by computational methods)