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2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate

In the title compound, C(14)H(25)NO(11)·2H(2)O, the primary hydroxyl group connected to the anomeric C atom of the N-acetyl-β-d-glucopyran­ose residue exhibits positional disorder, with occupancy factors for the α and β anomers of 0.77 and 0.23, respectively. The two torsion angles (Φ and Ψ) and the...

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Autores principales: Wada, Masahisa, Kobayashi, Kayoko, Nishimoto, Mamoru, Kitaoka, Motomitsu, Noguchi, Keiichi
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977301/
https://www.ncbi.nlm.nih.gov/pubmed/21583488
http://dx.doi.org/10.1107/S1600536809024775
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author Wada, Masahisa
Kobayashi, Kayoko
Nishimoto, Mamoru
Kitaoka, Motomitsu
Noguchi, Keiichi
author_facet Wada, Masahisa
Kobayashi, Kayoko
Nishimoto, Mamoru
Kitaoka, Motomitsu
Noguchi, Keiichi
author_sort Wada, Masahisa
collection PubMed
description In the title compound, C(14)H(25)NO(11)·2H(2)O, the primary hydroxyl group connected to the anomeric C atom of the N-acetyl-β-d-glucopyran­ose residue exhibits positional disorder, with occupancy factors for the α and β anomers of 0.77 and 0.23, respectively. The two torsion angles (Φ and Ψ) and the bridge angle (τ) that describe conformation of the glycosidic linkage between the galactopyran­ose and glucopyran­ose rings are Φ = −81.6 (3)°, Ψ = 118.1 (2)° and τ = 115.2 (2)°. Two water mol­ecules stabilize the mol­ecular packing by forming hydrogen bonds with the saccharide residues.
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spelling pubmed-29773012010-12-30 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate Wada, Masahisa Kobayashi, Kayoko Nishimoto, Mamoru Kitaoka, Motomitsu Noguchi, Keiichi Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(25)NO(11)·2H(2)O, the primary hydroxyl group connected to the anomeric C atom of the N-acetyl-β-d-glucopyran­ose residue exhibits positional disorder, with occupancy factors for the α and β anomers of 0.77 and 0.23, respectively. The two torsion angles (Φ and Ψ) and the bridge angle (τ) that describe conformation of the glycosidic linkage between the galactopyran­ose and glucopyran­ose rings are Φ = −81.6 (3)°, Ψ = 118.1 (2)° and τ = 115.2 (2)°. Two water mol­ecules stabilize the mol­ecular packing by forming hydrogen bonds with the saccharide residues. International Union of Crystallography 2009-07-04 /pmc/articles/PMC2977301/ /pubmed/21583488 http://dx.doi.org/10.1107/S1600536809024775 Text en © Wada et al. 2009 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Wada, Masahisa
Kobayashi, Kayoko
Nishimoto, Mamoru
Kitaoka, Motomitsu
Noguchi, Keiichi
2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title_full 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title_fullStr 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title_full_unstemmed 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title_short 2-Acetamido-2-de­oxy-3-O-β-d-galactopyranosyl-d-glucose dihydrate
title_sort 2-acetamido-2-de­oxy-3-o-β-d-galactopyranosyl-d-glucose dihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977301/
https://www.ncbi.nlm.nih.gov/pubmed/21583488
http://dx.doi.org/10.1107/S1600536809024775
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