Acta Crystallographica Section E (Jun 2012)

Brusatol

  • Shu-Zhi Hu,
  • Lu Jin,
  • Tong Yu,
  • Hai-Yan Tian,
  • Ren-Wang Jiang

DOI
https://doi.org/10.1107/S1600536812018582
Journal volume & issue
Vol. 68, no. 6
pp. o1592 – o1593

Abstract

Read online

The title compound, C26H32O11, is composed of an α,β-unsaturated cyclohexanone ring (A), two cyclohexane rings (B and C), a six-membered lactone ring (D) and tetrahydrofuran ring (E). Ring A exists in a half-chair conformation with a C atom displaced by 0.679 (2) Å from the mean plane through the remaining five atoms. Ring B exists in a normal chair conformation. Both rings C and D exist in a twisted-chair conformation due to the O-atom bridge and the carbonyl group in rings C and D, respectively. Ring E shows an envelope conformation with a C atom displaced by 0.761 (1) Å from the mean plane through the remaining five atoms. The ring junctions are A/B trans, B/C trans, C/D cis and D/E cis. An intramolecular O—H...O hydrogen bond occurs. In the crystal, O—H...O hydrogen bonds involving the hydroxy, lactone and ester groups and C—H...O interactions are observed.