Cargando…

Mol­ecular and crystal structure of gossypol tetra­methyl ether with an unknown solvate

The title compound, C(34)H(38)O(8) (systematic name: 5,5′-diisopropyl-2,2′,3,3′-tetra­meth­oxy-7,7′-dimethyl-2H,2′H-8,8′-bi­[naphtho­[1,8-bc]furan]-4,4′-diol), has been obtained from a gossypol solution in a mixture of dimethyl sulfate and methanol. The mol­ecule is situated on a twofold rotation ax...

Descripción completa

Detalles Bibliográficos
Autores principales: Honkeldieva, Muhabbat, Talipov, Samat, Mardanov, Rustam, Ibragimov, Bakhtiyar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384568/
https://www.ncbi.nlm.nih.gov/pubmed/25878814
http://dx.doi.org/10.1107/S2056989015000171
Descripción
Sumario:The title compound, C(34)H(38)O(8) (systematic name: 5,5′-diisopropyl-2,2′,3,3′-tetra­meth­oxy-7,7′-dimethyl-2H,2′H-8,8′-bi­[naphtho­[1,8-bc]furan]-4,4′-diol), has been obtained from a gossypol solution in a mixture of dimethyl sulfate and methanol. The mol­ecule is situated on a twofold rotation axis, so the asymmetric unit contains one half-mol­ecule. In the mol­ecule, the hy­droxy groups are involved in intra­molecular O—H⋯O hydrogen bonds, and the two naphthyl fragments are inclined each to other by 83.8 (1)°. In the crystal, weak C—H⋯O and C—H⋯π inter­actions consolidate the packing, which exhibits channels with an approximate diameter of 6 Å extending along the c-axis direction. These channels are filled with highly disordered solvent mol­ecules, so their estimated scattering contribution was subtracted from the observed diffraction data using the SQUEEZE option in PLATON [Spek, A. L. (2015). Acta Cryst. C71, 9–18].