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Hopeahainol C monohydrate
In the structure of the title compound, C(28)H(16)O(6)·H(2)O [systematic name 3,11-bis(4-hydroxyphenyl)-4,12-dioxapentacyclo[8.6.1.1(2,5).0(13,17).0(9,18)]octadeca-1(16),2,5(18),6,8,10,13(17),14-octaene-7,15-diol monohydrate], the hopeahainol C molecule lies about an inversion center with the solve...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120350/ https://www.ncbi.nlm.nih.gov/pubmed/21754780 http://dx.doi.org/10.1107/S1600536811017053 |
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author | Fun, Hoong-Kun Sudto, Kanokorn Ge, Hui-Ming Tan, Ren-Xiang Hannongbua, Supa Chantrapromma, Suchada |
author_facet | Fun, Hoong-Kun Sudto, Kanokorn Ge, Hui-Ming Tan, Ren-Xiang Hannongbua, Supa Chantrapromma, Suchada |
author_sort | Fun, Hoong-Kun |
collection | PubMed |
description | In the structure of the title compound, C(28)H(16)O(6)·H(2)O [systematic name 3,11-bis(4-hydroxyphenyl)-4,12-dioxapentacyclo[8.6.1.1(2,5).0(13,17).0(9,18)]octadeca-1(16),2,5(18),6,8,10,13(17),14-octaene-7,15-diol monohydrate], the hopeahainol C molecule lies about an inversion center with the solvent water molecule located on a crystallographic twofold axis. Hopeahainol C is an oligostillbenoid compound and was isolated from the bark of Shorea roxburghii G. Don. The five central fused rings are essentially planar with an r.m.s. deviation of 0.0173 (3) Å. The 4-hydroxyphenyl ring is twisted with respect to this plane, with the dihedral angle between the phenyl ring and the fused-ring system being 41.70 (10)°. The crystal features intermolecular O—H⋯O hydrogen bonds. These interactions link the hopeahainol C molecules into chains along the b axis. Water molecules are located interstitially between the hopeahainol C molecules linked by O(water)—H⋯O(hydroxy) and O(hydroxy)—H⋯O(water) hydrogen bonds. π–π interactions are also observed with centroid–centroid distances of 3.6056 (17) and 3.5622 (17) Å. Short O⋯O contacts [2.703 (2)–2.720 (3) Å] are also present in the crystal. |
format | Online Article Text |
id | pubmed-3120350 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-31203502011-07-13 Hopeahainol C monohydrate Fun, Hoong-Kun Sudto, Kanokorn Ge, Hui-Ming Tan, Ren-Xiang Hannongbua, Supa Chantrapromma, Suchada Acta Crystallogr Sect E Struct Rep Online Organic Papers In the structure of the title compound, C(28)H(16)O(6)·H(2)O [systematic name 3,11-bis(4-hydroxyphenyl)-4,12-dioxapentacyclo[8.6.1.1(2,5).0(13,17).0(9,18)]octadeca-1(16),2,5(18),6,8,10,13(17),14-octaene-7,15-diol monohydrate], the hopeahainol C molecule lies about an inversion center with the solvent water molecule located on a crystallographic twofold axis. Hopeahainol C is an oligostillbenoid compound and was isolated from the bark of Shorea roxburghii G. Don. The five central fused rings are essentially planar with an r.m.s. deviation of 0.0173 (3) Å. The 4-hydroxyphenyl ring is twisted with respect to this plane, with the dihedral angle between the phenyl ring and the fused-ring system being 41.70 (10)°. The crystal features intermolecular O—H⋯O hydrogen bonds. These interactions link the hopeahainol C molecules into chains along the b axis. Water molecules are located interstitially between the hopeahainol C molecules linked by O(water)—H⋯O(hydroxy) and O(hydroxy)—H⋯O(water) hydrogen bonds. π–π interactions are also observed with centroid–centroid distances of 3.6056 (17) and 3.5622 (17) Å. Short O⋯O contacts [2.703 (2)–2.720 (3) Å] are also present in the crystal. International Union of Crystallography 2011-05-14 /pmc/articles/PMC3120350/ /pubmed/21754780 http://dx.doi.org/10.1107/S1600536811017053 Text en © Fun 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 Fun, Hoong-Kun Sudto, Kanokorn Ge, Hui-Ming Tan, Ren-Xiang Hannongbua, Supa Chantrapromma, Suchada Hopeahainol C monohydrate |
title | Hopeahainol C monohydrate |
title_full | Hopeahainol C monohydrate |
title_fullStr | Hopeahainol C monohydrate |
title_full_unstemmed | Hopeahainol C monohydrate |
title_short | Hopeahainol C monohydrate |
title_sort | hopeahainol c monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120350/ https://www.ncbi.nlm.nih.gov/pubmed/21754780 http://dx.doi.org/10.1107/S1600536811017053 |
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