(3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.

The asymmetric unit of the title compound, C(18)H(26)O(5), which is known as α-zearalanol, contains two mol­ecules having the same conformation, with a r.m.s. deviation of less than 0.03 Å for all non-H atoms. In each independent mol­ecule, an intra­molecular O—H⋯O hydrogen bond stabilizes the mol­e...

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Detalles Bibliográficos
Autores principales: Drzymala, Sarah, Kraus, Werner, Emmerling, Franziska, Koch, Matthias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3515178/
https://www.ncbi.nlm.nih.gov/pubmed/23284405
http://dx.doi.org/10.1107/S1600536812041141
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author Drzymala, Sarah
Kraus, Werner
Emmerling, Franziska
Koch, Matthias
author_facet Drzymala, Sarah
Kraus, Werner
Emmerling, Franziska
Koch, Matthias
author_sort Drzymala, Sarah
collection PubMed
description The asymmetric unit of the title compound, C(18)H(26)O(5), which is known as α-zearalanol, contains two mol­ecules having the same conformation, with a r.m.s. deviation of less than 0.03 Å for all non-H atoms. In each independent mol­ecule, an intra­molecular O—H⋯O hydrogen bond stabilizes the mol­ecular conformation. In the crystal, O—H⋯O hydrogen bonds link the mol­ecules, forming infinite chains along [110] and [1-10].
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spelling pubmed-35151782013-01-02 (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one. Drzymala, Sarah Kraus, Werner Emmerling, Franziska Koch, Matthias Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(18)H(26)O(5), which is known as α-zearalanol, contains two mol­ecules having the same conformation, with a r.m.s. deviation of less than 0.03 Å for all non-H atoms. In each independent mol­ecule, an intra­molecular O—H⋯O hydrogen bond stabilizes the mol­ecular conformation. In the crystal, O—H⋯O hydrogen bonds link the mol­ecules, forming infinite chains along [110] and [1-10]. International Union of Crystallography 2012-10-06 /pmc/articles/PMC3515178/ /pubmed/23284405 http://dx.doi.org/10.1107/S1600536812041141 Text en © Drzymala et al. 2012 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
Drzymala, Sarah
Kraus, Werner
Emmerling, Franziska
Koch, Matthias
(3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title_full (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title_fullStr (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title_full_unstemmed (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title_short (3S,7R)-7,14,16-Trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1H-2-benzoxacyclo­tetra­decin-1-one.
title_sort (3s,7r)-7,14,16-trihy­droxy-3-methyl-3,4,5,6,7,8,9,10,11,12-deca­hydro-1h-2-benzoxacyclo­tetra­decin-1-one.
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3515178/
https://www.ncbi.nlm.nih.gov/pubmed/23284405
http://dx.doi.org/10.1107/S1600536812041141
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