Search results for "Pyranose"

showing 10 items of 11 documents

Synthesis and characterisation of N-glycosyl amines from the reaction between 4,6-O-benzylidene-D-glucopyranose and substituted aromatic amines and a…

2001

Twelve N-glycosyl amines were synthesised using 4,6-O–benzylidene-D-glucopyranose and different substituted aromatic amines, including some diamines that resulted in bis-glycosyl amines. Another set of six N–glycosyl amines was synthesised using different hexoses and pentoses and 2–(o–aminophenyl)benzimidazole. All compounds were isolated as solid products and purified, their elemental compositions were established, and these were characterised by NMR (1H and 13C), UV–Vis, and FTIR spectroscopy, by FAB mass spectrometry (molecular-ion peaks gave molecular weights), and by their optical rotations. While the protected saccharide, 4,6-O-benzylidene-D-glucopyranose, exists as a mixture of β and…

BenzimidazoleAnomerGlycosylationOptical RotationNuclear Magnetic Resonance SpectroscopyMolecular Sequence DataPentosesSynthesis (Chemical)macromolecular substancesMass spectrometryBiochemistryMedicinal chemistryMass SpectrometryAnalytical Chemistrychemistry.chemical_compoundOrganic chemistryGlycosylFourier transform infrared spectroscopyAminesPolycyclic Aromatic HydrocarbonsNuclear Magnetic Resonance BiomolecularHexosesMolecular massChemistryChemical shiftOrganic ChemistryHydrogen BondingGeneral MedicineD-GlucopyranoseMolecular WeightGlucoseCarbohydrate Sequencelipids (amino acids peptides and proteins)BenzimidazolesCarbohydrate research
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Crystal structures of O-acetylated 2-acylamino-2-deoxy-d-galactose derivatives

2003

The X-ray structures of 1,3,4,6-tetra-O-acetyl-2-deoxy-alpha-D-galactopyranoside derivatives with four different 2-(acylamino) substituents have been determined with Mo K(alpha) radiation at 123 K. The structure of the 2-acetylamino derivative and of its acyl-homologs with a 2-(propanoylamino)-, 2-(butanoylamino)-, and 2-(2-methyl-propanoylamino)-group crystallized in the monoclinic space group C2. The pyranose unit of all compounds has the usual 4C(1) shape. The different orientations of the 6-O-acetyl-groups are discussed. Conformations of the acylamino-group are compared to those found in the crystal structure of N-acetyl-alpha-D-galactosamine.

Models MolecularAcetylgalactosamineMolecular StructureChemistryStereochemistryOrganic ChemistryGalactoseHydrogen BondingGeneral MedicineCrystal structureCrystallography X-RayBiochemistryAnalytical ChemistryCrystallographyCarbohydrate SequencePyranoseAcetylation2-deoxy-D-galactoseCarbohydrate ConformationCrystallizationMonoclinic crystal systemCarbohydrate Research
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CCDC 188429: Experimental Crystal Structure Determination

2002

Related Article: G.Rajsekhar, U.B.Gangadharmath, C.P.Rao, P.Guionneau, P.K.Saarenketo, K.Rissanen|2002|Carbohydr.Res.|337|1477|doi:10.1016/S0008-6215(02)00191-X

Space GroupCrystallography46-O-Butylidene-alpha-D-glucopyranoseCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 218905: Experimental Crystal Structure Determination

2004

Related Article: M.U.Roslund, K.D.Klika, R.L.Lehtila, P.Tahtinen, R.Sillanpaa, R.Leino|2004|J.Org.Chem.|69|18|doi:10.1021/jo035400u

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters12346-Penta-O-acetyl-alpha-D-galactopyranoseExperimental 3D Coordinates
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CCDC 218904: Experimental Crystal Structure Determination

2004

Related Article: M.U.Roslund, K.D.Klika, R.L.Lehtila, P.Tahtinen, R.Sillanpaa, R.Leino|2004|J.Org.Chem.|69|18|doi:10.1021/jo035400u

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters12:34-Di-O-isopropylidene-6-O-(346-tri-O-acetyl-2-deoxy-2-(phthalimido)-beta-D-glucopyranosyl)-alpha-D-galactopyranoseExperimental 3D Coordinates
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CCDC 152521: Experimental Crystal Structure Determination

2001

Related Article: A.K.Sah, C.P.Rao, P.K.Saarenketo, E.K.Wegelius, K.Rissanen, E.Kolehmainen|2000|J.Chem.Soc.,Dalton Trans.||3681|doi:10.1039/b004854m

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters46-O-Ethylidene-alpha-D-glucopyranoseExperimental 3D Coordinates
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Unusual interaction extended between the pyranose ring oxygen and Zn(II) center in the complexes derived from 4,6-O-butylidene/ethylidene-N-(α-hydrox…

2003

The Zn(II) complexes of 4,6-O-butylidene/ethylidene-N-(α-hydroxynaphthylidene/o-hydroxybenzylidene)-β-Image -glucopyranosylamine have been synthesized and characterized using spectral and analytical methods and structure for one of the products was established. The geometry of the complexes vary from unusual distorted trigonal bipyramidal to pseudo-bicapped tetrahedron depending upon the extent of binding of pyranose ring oxygens to the Zn(II) ion, as evidenced from crystal structures. Such interaction is also reflected on the optical rotation and CD spectral properties of these complexes in solution.

StereochemistryCenter (category theory)chemistry.chemical_elementPyranose Ring OxygenCrystal structureOxygenIonInorganic ChemistryCrystallographyTrigonal bipyramidal molecular geometryPseudo Bicapped TetrahedronchemistryPyranoseZn(Ii) ComplexesMaterials ChemistryTetrahedronPhysical and Theoretical ChemistryOptical rotationInorganic Chemistry Communications
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α-d-Glucopyranose Adsorption on a Pd30 Cluster Supported on Boron Nitride Nanotube

2016

Boron nitride nanotube (BNNT) as an innovative support for carbohydrate transformation processes was evaluated, using density functional theory. The α-d-glucopyranose adsorption on a Pd30 cluster, supported on BNNT, was used to check both the local activity of topologically different metallic sites and the effects of the proximity of the BNNT surface to the same metallic sites. Detailed geometrical and electronic analyses performed on Pd30/BNNT and α-d-glucopyranose/Pd30/BNNT systems were discussed. It was observed that the deposition of the Pd30 cluster onto the BNNT support gives rise to an electronic rearrangement, determining a charge transfer from the support to the adsorbed metal clus…

Surface site reactivityChemical substanceNanotechnologyElectron donor02 engineering and technology010402 general chemistryDFT01 natural sciencesBoron nitride nanotubeCatalysisCatalysiCatalysisMetalchemistry.chemical_compoundAdsorptionSupported palladium catalystCluster (physics)Chemistry (all)Molecular electrostatic potentialGeneral Chemistry021001 nanoscience & nanotechnologyBoron nitride nanotube; DFT; Molecular electrostatic potential; Supported palladium catalyst; Surface site reactivity; α-d-Glucopyranose adsorption; Catalysis; Chemistry (all)0104 chemical scienceschemistryChemical physicsvisual_artα-d-Glucopyranose adsorptionvisual_art.visual_art_mediumDensity functional theory0210 nano-technologyScience technology and societyTopics in Catalysis
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N-Glycosylamines of 4,6-O-ethylidene-alpha-D-glucopyranose: synthesis, characterisation and structure of CO2H, Cl and F ortho-substituted phenyl deri…

2000

A saccharide based ligand suitable for metal binding (HLCOOH) has been synthesized using 4,6-O-ethylidene-alpha-D-glucopyranose (4,6-O-EGP) and anthranilic acid. A few analogous glycosylamines with chloro and fluoro ortho substitutions have also been synthesized and characterised. Complexes of HLCOOH with Na+, K+, Mg2+, Ca2+, Ba2+, Cd2+ and Hg2+ have been isolated and characterised fully. The crystal structures of 4,6-O-EGP, the chloro analogue of HLCOOH and the K+ complex of L-COOH are established. The anomeric nature, orientation of the binding core and the co-ordination aspects of K+ have been derived from these structures.

chemistry.chemical_classificationAnomerPlatinum(Iv)Metal bindingLigandStereochemistryDiacetoneglucoseGeneral ChemistryCrystal structureNickel(Ii) ComplexesD-GlucopyranoseEnantioselective SynthesesMetalCrown-Etherchemistry.chemical_compoundChemistrychemistryvisual_artCoordinationAnthranilic acidvisual_art.visual_art_mediumTitanium-Carbohydrate ComplexesGlycoside LigandsSugarsCrown etherIndraStra Global
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l-Arabinose Conformers Adsorption on Ruthenium Surfaces: A DFT Study

2012

Adsorption of 5 L-arabinose tautomers – one acyclic and four cyclic (α and β, pyranose and furanose) species – on a ruthenium surface was studied as a precursor-process of the, nowadays more and more, industrially important sugar catalytic hydrogenation on metal surfaces in water medium. The study was mostly referred to a 37-atom metal catalyst fragment, even though border-effects on the adsorption processes were also checked employing a 61-atom metal fragment. In order to figure out conformational effects on the title process the tautomer flexibility was, at first, investigated by the genetic-algorithm based code Balloon, considering the conformational spaces of the different aquo tautomer…

chemistry.chemical_element02 engineering and technology010402 general chemistry01 natural sciencesMetalAdsorptionComputational chemistryPhysical and Theoretical Chemistryl-Arabinose species conformational analysis ruthenium catalysts adsorption energies DFT studiesConformational isomerismchemistry.chemical_classification021001 nanoscience & nanotechnologyFuranoseTautomer0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsRutheniumGeneral EnergyPyranosechemistrySettore CHIM/03 - Chimica Generale E Inorganicavisual_artvisual_art.visual_art_mediumDensity functional theory0210 nano-technologyThe Journal of Physical Chemistry C
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