Compounds > 1-3-6-tri-o-galloyl-beta-d-glucose

1-3-6-tri-o-galloyl-beta-d-glucose and corilagin

1-3-6-tri-o-galloyl-beta-d-glucose has been researched along with corilagin* in 1 studies

Other Studies

1 other study(ies) available for 1-3-6-tri-o-galloyl-beta-d-glucose and corilagin

Article	Year
Molecular modeling of poly(ethylene oxide) model cofactors; 1,3,6-tri-O-galloyl-beta- d-glucose and corilagin. Journal of molecular modeling, 2002, Volume: 8, Issue:3 The most stable structures of two poly(ethylene oxide) (PEO) model cofactors, beta-1-O-galloyl-3,6-( R)-hexahydroxydiphenoyl- d-glucose (corilagin) and 1,3,6-tri-O-galloyl-beta- d-glucose (TGG), are calculated using molecular modeling and PM3 semiempirical molecular orbital theories. The theoretical PM3 structures agree with interpreted structures from experimental NMR; the glucopyranose ring of corilagin has a boat and TGG a chair conformation, for which the heats of formation, torsion angles, distances, van der Waals surface, and the infrared spectra are calculated. Topics: Carbohydrate Conformation; Gallic Acid; Glucose; Glucosides; Hydrolyzable Tannins; Models, Molecular; Molecular Structure; Phenols; Polyethylene Glycols; Rotation; Spectrophotometry, Infrared	2002

Article

Year

Molecular modeling of poly(ethylene oxide) model cofactors; 1,3,6-tri-O-galloyl-beta- d-glucose and corilagin.

Journal of molecular modeling, 2002, Volume: 8, Issue:3

The most stable structures of two poly(ethylene oxide) (PEO) model cofactors, beta-1-O-galloyl-3,6-( R)-hexahydroxydiphenoyl- d-glucose (corilagin) and 1,3,6-tri-O-galloyl-beta- d-glucose (TGG), are calculated using molecular modeling and PM3 semiempirical molecular orbital theories. The theoretical PM3 structures agree with interpreted structures from experimental NMR; the glucopyranose ring of corilagin has a boat and TGG a chair conformation, for which the heats of formation, torsion angles, distances, van der Waals surface, and the infrared spectra are calculated.

Topics: Carbohydrate Conformation; Gallic Acid; Glucose; Glucosides; Hydrolyzable Tannins; Models, Molecular; Molecular Structure; Phenols; Polyethylene Glycols; Rotation; Spectrophotometry, Infrared

2002