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(4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide
The title compound, C(11)H(22)NO(2) (+)·I(−), is a chiral molecule with five stereogenic centres. The absolute configuration was assigned from the synthesis and confirmed by the structure determination. The central six-membered ring of the indolizine system adopts a chair conformation, with two ato...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239140/ https://www.ncbi.nlm.nih.gov/pubmed/22199988 http://dx.doi.org/10.1107/S1600536811051099 |
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author | Vrábel, Viktor Sivý, Július Švorc, Ľubomír Šafář, Peter Žužiová, Jozefína |
author_facet | Vrábel, Viktor Sivý, Július Švorc, Ľubomír Šafář, Peter Žužiová, Jozefína |
author_sort | Vrábel, Viktor |
collection | PubMed |
description | The title compound, C(11)H(22)NO(2) (+)·I(−), is a chiral molecule with five stereogenic centres. The absolute configuration was assigned from the synthesis and confirmed by the structure determination. The central six-membered ring of the indolizine system adopts a chair conformation, with two atoms displaced by −0.690 (2) and 0.550 (2) Å from the plane of the other four atoms. The conformation of the pyrrolidine ring is close to that of an envelope, with the flap atom displaced by 0.563 (2) Å from the plane of the remaining four atoms. In the crystal, there are two O—H⋯I hydrogen bonds. |
format | Online Article Text |
id | pubmed-3239140 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32391402011-12-23 (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide Vrábel, Viktor Sivý, Július Švorc, Ľubomír Šafář, Peter Žužiová, Jozefína Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(11)H(22)NO(2) (+)·I(−), is a chiral molecule with five stereogenic centres. The absolute configuration was assigned from the synthesis and confirmed by the structure determination. The central six-membered ring of the indolizine system adopts a chair conformation, with two atoms displaced by −0.690 (2) and 0.550 (2) Å from the plane of the other four atoms. The conformation of the pyrrolidine ring is close to that of an envelope, with the flap atom displaced by 0.563 (2) Å from the plane of the remaining four atoms. In the crystal, there are two O—H⋯I hydrogen bonds. International Union of Crystallography 2011-11-30 /pmc/articles/PMC3239140/ /pubmed/22199988 http://dx.doi.org/10.1107/S1600536811051099 Text en © Vrábel et al. 2011 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 Vrábel, Viktor Sivý, Július Švorc, Ľubomír Šafář, Peter Žužiová, Jozefína (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title | (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title_full | (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title_fullStr | (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title_full_unstemmed | (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title_short | (4R,6S,7S,8S,8aS)-6-Ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
title_sort | (4r,6s,7s,8s,8as)-6-ethyl-7,8-dihydroxy-4-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-4-ium iodide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239140/ https://www.ncbi.nlm.nih.gov/pubmed/22199988 http://dx.doi.org/10.1107/S1600536811051099 |
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