Biomaterial Database

X-ray and conformational investigation of 6-deoxy-6-C-(1,5-di-O-acetyl-2,3-O- isopropylidene-beta-D-allo-pentofuranos-5-yl)-1,2:3,4-di-O-isopro pylidene-alpha-D-galactopyranose and 6-C-(benzyl 5-deoxy-2,3-O-isopropylidene-beta-D- ribofuranosid-5-yl)-1,2:3,4-di-O-isopropylidene-D-glycero-alpha-D-galac to-hexopyranose. 1994

J W Krajewski, and W Karpiesiuk, and A Banaszek

Institute of Organic Chemistry, Polish Academy of Sciences, Warszawa.

The structures of the title compounds (2b and 3) have been investigated in the solid state by X-ray methods. The crystals of 2b are monoclinic, space group P2(1), and of 3 orthorhombic, space group P2(1)2(1)2(1). The cell dimensions are: for 2b, a = 9.910(2), b = 11.745(1), c = 11.810(3) A, beta = 97.32(1) degrees; and for 3, a = 6.103(1), b = 15.954(1), c = 28.855(3) A. Both structures were solved by direct methods, and refined by a full-matrix, least-squares procedure giving for 2b, R = 0.0541 (unit weight), and for 3, R = 0.0451 (RW = 0.0445). The galactopyranose rings of 2b and 3 adopted a twist and a mixed twist-screw conformation, respectively. The absolute configuration at C-7 in 2b, as well as at C-6 in 3, was determined to be (R). Relatively strong intermolecular hydrogen bonds were observed in the crystal structure of 3.

UI	MeSH Term	Description	Entries
D008958	Models, Molecular	Models used experimentally or theoretically to study molecular shape, electronic properties, or interactions; includes analogous molecules, computer-generated graphics, and mechanical structures.	Molecular Models,Model, Molecular,Molecular Model
D008969	Molecular Sequence Data	Descriptions of specific amino acid, carbohydrate, or nucleotide sequences which have appeared in the published literature and/or are deposited in and maintained by databanks such as GENBANK, European Molecular Biology Laboratory (EMBL), National Biomedical Research Foundation (NBRF), or other sequence repositories.	Sequence Data, Molecular,Molecular Sequencing Data,Data, Molecular Sequence,Data, Molecular Sequencing,Sequencing Data, Molecular
D009904	Optical Rotation	The rotation of linearly polarized light as it passes through various media.	Optical Activity,Activity, Optical,Rotation, Optical
D002236	Carbohydrate Conformation	The characteristic 3-dimensional shape of a carbohydrate.	Carbohydrate Linkage,Carbohydrate Conformations,Carbohydrate Linkages,Conformation, Carbohydrate,Conformations, Carbohydrate,Linkage, Carbohydrate,Linkages, Carbohydrate
D002240	Carbohydrate Sequence	The sequence of carbohydrates within POLYSACCHARIDES; GLYCOPROTEINS; and GLYCOLIPIDS.	Carbohydrate Sequences,Sequence, Carbohydrate,Sequences, Carbohydrate
D004187	Disaccharides	Oligosaccharides containing two monosaccharide units linked by a glycosidic bond.	Disaccharide
D015394	Molecular Structure	The location of the atoms, groups or ions relative to one another in a molecule, as well as the number, type and location of covalent bonds.	Structure, Molecular,Molecular Structures,Structures, Molecular
D018360	Crystallography, X-Ray	The study of crystal structure using X-RAY DIFFRACTION techniques. (McGraw-Hill Dictionary of Scientific and Technical Terms, 4th ed)	X-Ray Crystallography,Crystallography, X Ray,Crystallography, Xray,X Ray Crystallography,Xray Crystallography,Crystallographies, X Ray,X Ray Crystallographies