Information card for entry 1504459

Structure parameters

• Formula: C23 H35 N O5
• Calculated formula: C23 H35 N O5
• SMILES: N12[C@@H]3[C@@](O)(CC[C@@]4([C@H](C1)CCC1=C5[C@]34C[C@@H]([C@@H]5CC1)C(=O)OC)CO)[C@H](C2)C.O
• Title of publication: Daphniphyllum and diterpenoid alkaloids from Daphniphyllum longeracemosum.
• Authors of publication: Li, Chun-Shun; Di, Ying-Tong; Mu, Shu-Zhen; He, Hong-Ping; Zhang, Qiang; Fang, Xin; Zhang, Yu; Li, Shun-Lin; Lu, Yang; Gong, Yan-Qing; Hao, Xiao-Jiang
• Journal of publication: Journal of natural products
• Year of publication: 2008
• Journal volume: 71
• Journal issue: 7
• Pages of publication: 1202 - 1206
• a: 8.799 ± 0.002 Å
• b: 14.981 ± 0.003 Å
• c: 15.655 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2063.6 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0399
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No