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Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol
The title compound, C(20)H(42)O(3)S(2)Si, crystallized with two independent molecules (A and B) in the asymmetric unit. They consist of syn,anti,anti-stereotetrads with a 1,3-dithiane motif and a primary alcohol protected as the triisopropyl silyl ether. The 1,3-dithiane ring adopts a chair conf...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257393/ https://www.ncbi.nlm.nih.gov/pubmed/25553049 http://dx.doi.org/10.1107/S160053681402443X |
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author | Cruz-Montanez, Alejandra Piñero Cruz, Dalice M. Prieto, Jose A. |
author_facet | Cruz-Montanez, Alejandra Piñero Cruz, Dalice M. Prieto, Jose A. |
author_sort | Cruz-Montanez, Alejandra |
collection | PubMed |
description | The title compound, C(20)H(42)O(3)S(2)Si, crystallized with two independent molecules (A and B) in the asymmetric unit. They consist of syn,anti,anti-stereotetrads with a 1,3-dithiane motif and a primary alcohol protected as the triisopropyl silyl ether. The 1,3-dithiane ring adopts a chair conformation, while the rest of each molecule displays a common zigzag conformation. There is an intramolecular O—H⋯O hydrogen bond in each molecule. In the crystal, the A and B molecules are linked via O—H⋯O hydrogen bonds, forming –A–B–A--B-- chains along [010]. The absolute structure was determined by resonant scattering (anomalous scattering) [Flack parameter = 0.035 (8)]. |
format | Online Article Text |
id | pubmed-4257393 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42573932014-12-31 Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol Cruz-Montanez, Alejandra Piñero Cruz, Dalice M. Prieto, Jose A. Acta Crystallogr Sect E Struct Rep Online Data Reports The title compound, C(20)H(42)O(3)S(2)Si, crystallized with two independent molecules (A and B) in the asymmetric unit. They consist of syn,anti,anti-stereotetrads with a 1,3-dithiane motif and a primary alcohol protected as the triisopropyl silyl ether. The 1,3-dithiane ring adopts a chair conformation, while the rest of each molecule displays a common zigzag conformation. There is an intramolecular O—H⋯O hydrogen bond in each molecule. In the crystal, the A and B molecules are linked via O—H⋯O hydrogen bonds, forming –A–B–A--B-- chains along [010]. The absolute structure was determined by resonant scattering (anomalous scattering) [Flack parameter = 0.035 (8)]. International Union of Crystallography 2014-11-21 /pmc/articles/PMC4257393/ /pubmed/25553049 http://dx.doi.org/10.1107/S160053681402443X Text en © Cruz-Montanez et al. 2014 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 | Data Reports Cruz-Montanez, Alejandra Piñero Cruz, Dalice M. Prieto, Jose A. Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title | Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title_full | Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title_fullStr | Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title_full_unstemmed | Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title_short | Crystal structure of (−)-(2R,3S,4R,5R)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
title_sort | crystal structure of (−)-(2r,3s,4r,5r)-5-(1,3-dithian-2-yl)-3-methyl-1-(triisopropylsilyloxy)hexane-2,4-diol |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257393/ https://www.ncbi.nlm.nih.gov/pubmed/25553049 http://dx.doi.org/10.1107/S160053681402443X |
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