11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate

In the title compound, C(21)H(28)O(4)·H(2)O, the cyclo­hexa­dienone ring is planar (r.m.s. deviation 0.0186 Å), whereas the two cyclo­hexane rings and the cyclo­hexa­none ring adopt chair conformations. The crystal structure is stabilized by O—H⋯O and C—H⋯O hydrogen bonds.

Detalles Bibliográficos
Autores principales: Qiu, Ya, Chen, Ying, Xia, Peng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968801/
https://www.ncbi.nlm.nih.gov/pubmed/21582635
http://dx.doi.org/10.1107/S1600536809010770
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author Qiu, Ya
Chen, Ying
Xia, Peng
author_facet Qiu, Ya
Chen, Ying
Xia, Peng
author_sort Qiu, Ya
collection PubMed
description In the title compound, C(21)H(28)O(4)·H(2)O, the cyclo­hexa­dienone ring is planar (r.m.s. deviation 0.0186 Å), whereas the two cyclo­hexane rings and the cyclo­hexa­none ring adopt chair conformations. The crystal structure is stabilized by O—H⋯O and C—H⋯O hydrogen bonds.
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spelling pubmed-29688012010-12-30 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate Qiu, Ya Chen, Ying Xia, Peng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(21)H(28)O(4)·H(2)O, the cyclo­hexa­dienone ring is planar (r.m.s. deviation 0.0186 Å), whereas the two cyclo­hexane rings and the cyclo­hexa­none ring adopt chair conformations. The crystal structure is stabilized by O—H⋯O and C—H⋯O hydrogen bonds. International Union of Crystallography 2009-03-31 /pmc/articles/PMC2968801/ /pubmed/21582635 http://dx.doi.org/10.1107/S1600536809010770 Text en © Qiu et al. 2009 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
Qiu, Ya
Chen, Ying
Xia, Peng
11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title_full 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title_fullStr 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title_full_unstemmed 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title_short 11β,17aα-Dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
title_sort 11β,17aα-dihydr­oxy-17aβ-methyl-d-homoandrosta-1,4-diene-3,17-dione monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968801/
https://www.ncbi.nlm.nih.gov/pubmed/21582635
http://dx.doi.org/10.1107/S1600536809010770
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