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Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone

The title compound (systematic name: 5-hydroxy-3,6,7,8-tetramethoxy-2-phenyl-4H-chromen-4-one), C(19)H(18)O(7), is a flavone that was isolated from a butanol extract of the herb Scutellaria nepetoides M. Pop. The flavone mol­ecule is almost planar, with a dihedral angle between the planes of the ben...

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Autores principales: Aisa, Haji Akber, Izotova, Lidiya, Karimov, Abdurashid, Botirov, Erkin, Mamadrahimov, Azimjon, Ibragimov, Bahtiyar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7643244/
https://www.ncbi.nlm.nih.gov/pubmed/33209346
http://dx.doi.org/10.1107/S2056989020013596
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author Aisa, Haji Akber
Izotova, Lidiya
Karimov, Abdurashid
Botirov, Erkin
Mamadrahimov, Azimjon
Ibragimov, Bahtiyar
author_facet Aisa, Haji Akber
Izotova, Lidiya
Karimov, Abdurashid
Botirov, Erkin
Mamadrahimov, Azimjon
Ibragimov, Bahtiyar
author_sort Aisa, Haji Akber
collection PubMed
description The title compound (systematic name: 5-hydroxy-3,6,7,8-tetramethoxy-2-phenyl-4H-chromen-4-one), C(19)H(18)O(7), is a flavone that was isolated from a butanol extract of the herb Scutellaria nepetoides M. Pop. The flavone mol­ecule is almost planar, with a dihedral angle between the planes of the benzo­pyran-4-one group and the attached phenyl ring of 6.4 (4)°. The 5-hy­droxy group forms a strong intra­molecular hydrogen bond with the carbonyl group, resulting in a six-membered hydrogen-bonded ring. The crystal structure has triclinic (P [Image: see text]) symmetry. In the crystal, the mol­ecules are linked by C—H⋯O hydrogen bonds into a two dimensional network parallel to the ab plane. The Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H⋯H (53.9%) and H⋯O/O⋯H (20.9%) inter­actions.
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spelling pubmed-76432442020-11-17 Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone Aisa, Haji Akber Izotova, Lidiya Karimov, Abdurashid Botirov, Erkin Mamadrahimov, Azimjon Ibragimov, Bahtiyar Acta Crystallogr E Crystallogr Commun Research Communications The title compound (systematic name: 5-hydroxy-3,6,7,8-tetramethoxy-2-phenyl-4H-chromen-4-one), C(19)H(18)O(7), is a flavone that was isolated from a butanol extract of the herb Scutellaria nepetoides M. Pop. The flavone mol­ecule is almost planar, with a dihedral angle between the planes of the benzo­pyran-4-one group and the attached phenyl ring of 6.4 (4)°. The 5-hy­droxy group forms a strong intra­molecular hydrogen bond with the carbonyl group, resulting in a six-membered hydrogen-bonded ring. The crystal structure has triclinic (P [Image: see text]) symmetry. In the crystal, the mol­ecules are linked by C—H⋯O hydrogen bonds into a two dimensional network parallel to the ab plane. The Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H⋯H (53.9%) and H⋯O/O⋯H (20.9%) inter­actions. International Union of Crystallography 2020-10-13 /pmc/articles/PMC7643244/ /pubmed/33209346 http://dx.doi.org/10.1107/S2056989020013596 Text en © Aisa et al. 2020 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Aisa, Haji Akber
Izotova, Lidiya
Karimov, Abdurashid
Botirov, Erkin
Mamadrahimov, Azimjon
Ibragimov, Bahtiyar
Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title_full Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title_fullStr Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title_full_unstemmed Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title_short Crystal, mol­ecular structure and Hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
title_sort crystal, mol­ecular structure and hirshheld surface analysis of 5-hy­droxy-3,6,7,8-tetra­meth­oxy­flavone
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7643244/
https://www.ncbi.nlm.nih.gov/pubmed/33209346
http://dx.doi.org/10.1107/S2056989020013596
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