Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate

In the title compound, C(39)H(58)O(4), the steroid rings A and C adopt a chair conformation, while ring B adopts a half-chair conformation, and ring D has an envelope conformation, with the methyl-substituted C atom as the flap. In the crystal, mol­ecules pack within layers parallel to (100), with t...

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Autores principales: Bugenhagen, Bernhard, Munk, Ariane, Vill, Volkmar, Al Jasem, Yosef, Thiemann, Thies
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384600/
https://www.ncbi.nlm.nih.gov/pubmed/25878888
http://dx.doi.org/10.1107/S2056989014028278
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author Bugenhagen, Bernhard
Munk, Ariane
Vill, Volkmar
Al Jasem, Yosef
Thiemann, Thies
author_facet Bugenhagen, Bernhard
Munk, Ariane
Vill, Volkmar
Al Jasem, Yosef
Thiemann, Thies
author_sort Bugenhagen, Bernhard
collection PubMed
description In the title compound, C(39)H(58)O(4), the steroid rings A and C adopt a chair conformation, while ring B adopts a half-chair conformation, and ring D has an envelope conformation, with the methyl-substituted C atom as the flap. In the crystal, mol­ecules pack within layers parallel to (100), with their long axis parallel to the [101] direction. Adjacent layers are linked via C—H⋯O hydrogen bonds and C—H⋯π inter­actions, forming a three-dimensional framework.
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spelling pubmed-43846002015-04-15 Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate Bugenhagen, Bernhard Munk, Ariane Vill, Volkmar Al Jasem, Yosef Thiemann, Thies Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(39)H(58)O(4), the steroid rings A and C adopt a chair conformation, while ring B adopts a half-chair conformation, and ring D has an envelope conformation, with the methyl-substituted C atom as the flap. In the crystal, mol­ecules pack within layers parallel to (100), with their long axis parallel to the [101] direction. Adjacent layers are linked via C—H⋯O hydrogen bonds and C—H⋯π inter­actions, forming a three-dimensional framework. International Union of Crystallography 2015-01-10 /pmc/articles/PMC4384600/ /pubmed/25878888 http://dx.doi.org/10.1107/S2056989014028278 Text en © Bugenhagen et al. 2015 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
Bugenhagen, Bernhard
Munk, Ariane
Vill, Volkmar
Al Jasem, Yosef
Thiemann, Thies
Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title_full Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title_fullStr Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title_full_unstemmed Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title_short Crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
title_sort crystal structure of cholest-5-en-3β-yl 3-(2,4-dimeth­oxy-3-methyl­phen­yl)prop-2-enoate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384600/
https://www.ncbi.nlm.nih.gov/pubmed/25878888
http://dx.doi.org/10.1107/S2056989014028278
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