Information card for entry 7150272

Structure parameters

• Formula: C36 H44 O8
• Calculated formula: C36 H44 O8
• Title of publication: A cytotoxic triketone-phloroglucinol-bullatenone hybrid from Lophomyrtus bullata.
• Authors of publication: Larsen, Lesley; Benn, Michael H.; Parvez, Masood; Perry, Nigel B.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2005
• Journal volume: 3
• Journal issue: 17
• Pages of publication: 3236 - 3241
• a: 16.999 ± 0.005 Å
• b: 11.735 ± 0.008 Å
• c: 17.495 ± 0.01 Å
• α: 90°
• β: 112.405 ± 0.017°
• γ: 90°
• Cell volume: 3227 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.122
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.145
• Weighted residual factors for all reflections included in the refinement: 0.177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No