Information card for entry 1506589

Structure parameters

• Formula: C31 H54 O3
• Calculated formula: C31 H52 O3
• Title of publication: Compound representatives of a new type of triterpenoid from Aglaia odorata.
• Authors of publication: Cai, Xiang-Hai; Luo, Xiao-Dong; Zhou, Jun; Hao, Xiao-Jiang
• Journal of publication: Organic letters
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 14
• Pages of publication: 2877 - 2879
• a: 13.118 ± 0.003 Å
• b: 31.435 ± 0.008 Å
• c: 7.245 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2987.6 ± 1.1 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 3
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.1609
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1272
• Weighted residual factors for all reflections included in the refinement: 0.1451
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No