Information card for entry 1543448

Structure parameters

• Formula: C16 H22 N O4.5
• Calculated formula: C16 H22 N O4.5
• SMILES: [C@H]12C[C@H](CC[C@@]31[C@H](CN(Cc1ccc(c(c31)O2)O)C)O)O.O
• Title of publication: Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.
• Authors of publication: Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin
• Journal of publication: Journal of natural products
• Year of publication: 2016
• Journal volume: 79
• Journal issue: 4
• Pages of publication: 760 - 766
• a: 8.0372 ± 0.0001 Å
• b: 15.6818 ± 0.0002 Å
• c: 22.5648 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2844.02 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1382
• Weighted residual factors for all reflections included in the refinement: 0.1976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.163
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Duplicate of: 1542563
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No