CERATIOLIN FROM CERATIOLA ERICOIDES

Citation
Hy. Tak et al., CERATIOLIN FROM CERATIOLA ERICOIDES, Acta crystallographica. Section C, Crystal structure communications, 49, 1993, pp. 1990-1992
Citations number
10
Categorie Soggetti
Crystallography
ISSN journal
01082701
Volume
49
Year of publication
1993
Part
11
Pages
1990 - 1992
Database
ISI
SICI code
0108-2701(1993)49:<1990:CFCE>2.0.ZU;2-R
Abstract
The title compound, 3-phenyl-1-(2,4,5-trihydroxy-3,5-dimethyl-6-oxo- 1 ,5-cyclohexadienyl)-1-propanone, was confirmed to be a dihydrochalcone containing a fully substituted cyclohexadienone ring. This ring has a flattened half-chair conformation, with the dione C atom 0.203 (1) An gstrom out of the diene plane and the tetrahedral C atom 0.184(1) Angs trom to the opposite side of the plane. The hydroxy substituent on the tetrahedral C atom forms an intramolecular hydrogen bond to the carbo nyl O atom of the cyclohexadienone, having an O...O distance of 2.658 (1) Angstrom and an angle at H of 116(2)degrees. One of the other hydr oxy substituents forms an intramolecular hydrogen bond with the carbon yl O atom of the beta-phenylpropionyl group, having an O...O distance of 2.414 (2) A and an angle at H of 160 (2)degrees.