Information card for entry 1512241

Structure parameters

• Formula: C30 H25 N O11
• Calculated formula: C30 H25 N O11
• SMILES: O1c2ccc(OC)c(O)c2C(=O)c2c1c(O)c1CCc3cc4C[C@@]5(OC(=O)[C@@](N5C(=O)c4c(O)c3c1c2O)(CO)C)C
• Title of publication: Caspase-3-Dependent Apoptosis of Citreamicin ε-Induced HeLa Cells Is Associated with Reactive Oxygen Species Generation
• Authors of publication: Liu, Ling-Li; He, Li-Sheng; Xu, Ying; Han, Zhuang; Li, Yong-Xin; Zhong, Jia-Liang; Guo, Xian-Rong; Zhang, Xi-Xiang; Ko, Kam Ming; Qian, Pei-Yuan
• Journal of publication: Chemical Research in Toxicology
• Year of publication: 2013
• Journal volume: 26
• Journal issue: 7
• Pages of publication: 1055
• a: 8.1965 ± 0.0016 Å
• b: 14.197 ± 0.003 Å
• c: 21.934 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2552.4 ± 0.9 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: 0.0815
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1106
• Weighted residual factors for all reflections included in the refinement: 0.1308
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No