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(3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid

The mol­ecule of the title compound, C(20)H(32)O(4), is built up from three fused five-membered, six-membered and seven-membered rings. The five-membered ring has an envelope conformation, whereas the six- and seven-membered rings have chair conformations. The crystal structure is stabilized by stro...

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Autores principales: Brito, Iván, Bórquez, Jorge, Loyola, Luis Alberto, Cárdenas, Alejandro, López-Rodríguez, Matías
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961850/
https://www.ncbi.nlm.nih.gov/pubmed/21202969
http://dx.doi.org/10.1107/S1600536808018941
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author Brito, Iván
Bórquez, Jorge
Loyola, Luis Alberto
Cárdenas, Alejandro
López-Rodríguez, Matías
author_facet Brito, Iván
Bórquez, Jorge
Loyola, Luis Alberto
Cárdenas, Alejandro
López-Rodríguez, Matías
author_sort Brito, Iván
collection PubMed
description The mol­ecule of the title compound, C(20)H(32)O(4), is built up from three fused five-membered, six-membered and seven-membered rings. The five-membered ring has an envelope conformation, whereas the six- and seven-membered rings have chair conformations. The crystal structure is stabilized by strong inter­molecular O—H⋯O hydrogen bonds, forming a three-dimensional network. The absolute configuration was assigned on the basis of earlier chemical studies.
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spelling pubmed-29618502010-12-30 (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid Brito, Iván Bórquez, Jorge Loyola, Luis Alberto Cárdenas, Alejandro López-Rodríguez, Matías Acta Crystallogr Sect E Struct Rep Online Organic Papers The mol­ecule of the title compound, C(20)H(32)O(4), is built up from three fused five-membered, six-membered and seven-membered rings. The five-membered ring has an envelope conformation, whereas the six- and seven-membered rings have chair conformations. The crystal structure is stabilized by strong inter­molecular O—H⋯O hydrogen bonds, forming a three-dimensional network. The absolute configuration was assigned on the basis of earlier chemical studies. International Union of Crystallography 2008-06-28 /pmc/articles/PMC2961850/ /pubmed/21202969 http://dx.doi.org/10.1107/S1600536808018941 Text en © Brito et al. 2008 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
Brito, Iván
Bórquez, Jorge
Loyola, Luis Alberto
Cárdenas, Alejandro
López-Rodríguez, Matías
(3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title_full (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title_fullStr (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title_full_unstemmed (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title_short (3S,3aS,5aS,7S,8S,10aS,10bR)-7,8-Dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1H)-carboxylic acid
title_sort (3s,3as,5as,7s,8s,10as,10br)-7,8-dihydr­oxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-deca­hydro­cyclo­hepta­[e]indene-3a(1h)-carboxylic acid
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961850/
https://www.ncbi.nlm.nih.gov/pubmed/21202969
http://dx.doi.org/10.1107/S1600536808018941
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