Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)

In the title compound, C21H24O4 (systematic name: 4,5′-diallyl-2,2′,3′-trimethoxydiphenyl ether), the aromatic rings lie almost perpendicular to each other [dihedral angle = 85.96 (2)°]. The allyl side chains show similar configurations, with Car—C—C=C (ar = aromatic) torsion angles of −123.62 (12)...

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Main Authors: Simone S. Grecco, Gerold Jerz, Joao Henrique G. Lago, Peter G. Jones
Format: Article
Language:English
Published: International Union of Crystallography 2018-04-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989018003717
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author Simone S. Grecco
Gerold Jerz
Joao Henrique G. Lago
Peter G. Jones
author_facet Simone S. Grecco
Gerold Jerz
Joao Henrique G. Lago
Peter G. Jones
author_sort Simone S. Grecco
collection DOAJ
description In the title compound, C21H24O4 (systematic name: 4,5′-diallyl-2,2′,3′-trimethoxydiphenyl ether), the aromatic rings lie almost perpendicular to each other [dihedral angle = 85.96 (2)°]. The allyl side chains show similar configurations, with Car—C—C=C (ar = aromatic) torsion angles of −123.62 (12) and −115.54 (12)°. A possible weak intramolecular C—H...O interaction is observed. In the crystal, molecules are connected by two C—H...O hydrogen bonds, forming undulating layers lying parallel to the bc plane. Weak C—H...π and π–π stacking interactions also occur.
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spelling doaj.art-4c71e840307a45ea95af7f6c2dfc43a32022-12-21T17:17:18ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902018-04-0174451852110.1107/S2056989018003717hb7741Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)Simone S. Grecco0Gerold Jerz1Joao Henrique G. Lago2Peter G. Jones3Institute of Food Chemistry, Technical University of Braunschweig, Schleinitzstrasse 20, 38106 Braunschweig, GermanyInstitute of Food Chemistry, Technical University of Braunschweig, Schleinitzstrasse 20, 38106 Braunschweig, GermanyCenter of Natural Sciences and Humanities, Federal University of ABC, 09210-580, Santo André, BrazilInstitute of Inorganic and Analytical Chemistry, Technical University of Braunschweig, Hagenring 30, 38106 Braunschweig, GermanyIn the title compound, C21H24O4 (systematic name: 4,5′-diallyl-2,2′,3′-trimethoxydiphenyl ether), the aromatic rings lie almost perpendicular to each other [dihedral angle = 85.96 (2)°]. The allyl side chains show similar configurations, with Car—C—C=C (ar = aromatic) torsion angles of −123.62 (12) and −115.54 (12)°. A possible weak intramolecular C—H...O interaction is observed. In the crystal, molecules are connected by two C—H...O hydrogen bonds, forming undulating layers lying parallel to the bc plane. Weak C—H...π and π–π stacking interactions also occur.http://scripts.iucr.org/cgi-bin/paper?S2056989018003717crystal structureneolignaneugenol
spellingShingle Simone S. Grecco
Gerold Jerz
Joao Henrique G. Lago
Peter G. Jones
Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
Acta Crystallographica Section E: Crystallographic Communications
crystal structure
neolignan
eugenol
title Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
title_full Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
title_fullStr Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
title_full_unstemmed Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
title_short Crystal structure of Dehydrodieugenol B methyl ether, a neolignan from Nectandra leucantha Nees and Mart (Lauraceae)
title_sort crystal structure of dehydrodieugenol b methyl ether a neolignan from nectandra leucantha nees and mart lauraceae
topic crystal structure
neolignan
eugenol
url http://scripts.iucr.org/cgi-bin/paper?S2056989018003717
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