(S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate

The zwitterionic title compound, C(12)H(17)NO(3)S, is a reduced Schiff base derived from (S)-N-(2-hy­droxy­benzyl­idene)methio­nine. An intra­molecular inter­action between the N—H and carboxyl­ate groups forms a roughly planar (r.m.s. deviation = 0.1405 Å) five-membered ring containing the H(N), N,...

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Autores principales: Brancatelli, Giovanna, Bruno, Giuseppe, Nicoló, Francesco, Canfora, Loredana, Ruisi, Giuseppe
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120446/
https://www.ncbi.nlm.nih.gov/pubmed/21754759
http://dx.doi.org/10.1107/S1600536811016564
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author Brancatelli, Giovanna
Bruno, Giuseppe
Nicoló, Francesco
Canfora, Loredana
Ruisi, Giuseppe
author_facet Brancatelli, Giovanna
Bruno, Giuseppe
Nicoló, Francesco
Canfora, Loredana
Ruisi, Giuseppe
author_sort Brancatelli, Giovanna
collection PubMed
description The zwitterionic title compound, C(12)H(17)NO(3)S, is a reduced Schiff base derived from (S)-N-(2-hy­droxy­benzyl­idene)methio­nine. An intra­molecular inter­action between the N—H and carboxyl­ate groups forms a roughly planar (r.m.s. deviation = 0.1405 Å) five-membered ring containing the H(N), N, Cα, C(carboxyl­ate) and O atoms in a penta­gonal conformation. In the crystal, a supra­molecular triangle-shaped motif is generated by mol­ecules held together by O—H⋯O and N—H⋯O hydrogen bonds.
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spelling pubmed-31204462011-07-13 (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate Brancatelli, Giovanna Bruno, Giuseppe Nicoló, Francesco Canfora, Loredana Ruisi, Giuseppe Acta Crystallogr Sect E Struct Rep Online Organic Papers The zwitterionic title compound, C(12)H(17)NO(3)S, is a reduced Schiff base derived from (S)-N-(2-hy­droxy­benzyl­idene)methio­nine. An intra­molecular inter­action between the N—H and carboxyl­ate groups forms a roughly planar (r.m.s. deviation = 0.1405 Å) five-membered ring containing the H(N), N, Cα, C(carboxyl­ate) and O atoms in a penta­gonal conformation. In the crystal, a supra­molecular triangle-shaped motif is generated by mol­ecules held together by O—H⋯O and N—H⋯O hydrogen bonds. International Union of Crystallography 2011-05-11 /pmc/articles/PMC3120446/ /pubmed/21754759 http://dx.doi.org/10.1107/S1600536811016564 Text en © Brancatelli 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
Brancatelli, Giovanna
Bruno, Giuseppe
Nicoló, Francesco
Canfora, Loredana
Ruisi, Giuseppe
(S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title_full (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title_fullStr (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title_full_unstemmed (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title_short (S)-2-[(2-Hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
title_sort (s)-2-[(2-hy­droxy­benz­yl)aza­nium­yl]-4-(methyl­sulfan­yl)butano­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120446/
https://www.ncbi.nlm.nih.gov/pubmed/21754759
http://dx.doi.org/10.1107/S1600536811016564
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AT canforaloredana s22hydroxybenzylazaniumyl4methylsulfanylbutanoate
AT ruisigiuseppe s22hydroxybenzylazaniumyl4methylsulfanylbutanoate

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