1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose

1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose

The title compound, C13H18FNO5, consists of d-fructose with an aromatic amine. The carbohydrate chain is in the acyclic keto form and has the zigzag conformation, while the solid-state NMR data suggests a conformational dimorphism at the aromatic amine group. The carbohydrate portion is involved in...

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Bibliographic Details
Main Authors: Valeri V. Mossine, Charles L. Barnes, Thomas P. Mawhinney
Format: Article
Language:English
Published: International Union of Crystallography 2018-03-01
Series:IUCrData
Subjects:
crystal structure
D-fructosamine
acyclic carbohydrate
hydrogen bonding
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2414314618003693
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spelling doaj-2ea6a4b006ac4052a161db1035504fd22020-11-24T22:47:15ZengInternational Union of CrystallographyIUCrData2414-31462018-03-0133x18036910.1107/S2414314618003693lh40331-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexuloseValeri V. Mossine0Charles L. Barnes1Thomas P. Mawhinney2Department of Biochemistry, University of Missouri, Columbia, MO65211, USADepartment of Chemistry, University of Missouri, Columbia, MO65211, USADepartment of Biochemistry, University of Missouri, Columbia, MO 65211, USAThe title compound, C13H18FNO5, consists of d-fructose with an aromatic amine. The carbohydrate chain is in the acyclic keto form and has the zigzag conformation, while the solid-state NMR data suggests a conformational dimorphism at the aromatic amine group. The carbohydrate portion is involved in extensive O—H...O hydrogen bonding, which forms a two-dimensional network parallel to (001) and organized into fused homodromic ring patterns. The Hirshfeld surface fingerprint plots reveal a major contribution of the non-polar H...H and C...H interactions to the crystal packing forces.http://scripts.iucr.org/cgi-bin/paper?S2414314618003693crystal structureD-fructosamineacyclic carbohydratehydrogen bonding
collection DOAJ
language English
format Article
sources DOAJ
author Valeri V. Mossine
Charles L. Barnes
Thomas P. Mawhinney
spellingShingle Valeri V. Mossine
Charles L. Barnes
Thomas P. Mawhinney
1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
IUCrData
crystal structure
D-fructosamine
acyclic carbohydrate
hydrogen bonding
author_facet Valeri V. Mossine
Charles L. Barnes
Thomas P. Mawhinney
author_sort Valeri V. Mossine
title 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
title_short 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
title_full 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
title_fullStr 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
title_full_unstemmed 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-d-arabino-hexulose
title_sort 1-deoxy-1-(n-methyl-4-fluorophenylamino)-d-arabino-hexulose
publisher International Union of Crystallography
series IUCrData
issn 2414-3146
publishDate 2018-03-01
description The title compound, C13H18FNO5, consists of d-fructose with an aromatic amine. The carbohydrate chain is in the acyclic keto form and has the zigzag conformation, while the solid-state NMR data suggests a conformational dimorphism at the aromatic amine group. The carbohydrate portion is involved in extensive O—H...O hydrogen bonding, which forms a two-dimensional network parallel to (001) and organized into fused homodromic ring patterns. The Hirshfeld surface fingerprint plots reveal a major contribution of the non-polar H...H and C...H interactions to the crystal packing forces.
topic crystal structure
D-fructosamine
acyclic carbohydrate
hydrogen bonding
url http://scripts.iucr.org/cgi-bin/paper?S2414314618003693
work_keys_str_mv AT valerivmossine 1deoxy1nmethyl4fluorophenylaminodarabinohexulose
AT charleslbarnes 1deoxy1nmethyl4fluorophenylaminodarabinohexulose
AT thomaspmawhinney 1deoxy1nmethyl4fluorophenylaminodarabinohexulose
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