Information card for entry 7221671

Structure parameters

• Formula: C15 H20 O6
• Calculated formula: C15 H20 O6
• SMILES: O1C(=O)c2c(O)c(O)c(OC)cc2C[C@H]1C[C@@H](O)CCC
• Title of publication: New α-Glucosidase Inhibitors from a Marine Sponge-derived Fungus Aspergillus sp. OUCMDZ-1583
• Authors of publication: Zhu, Weiming; Kong, Fandong; Zhao, Chengying; Hao, Jie; Wang, Cong; Wang, Wei; Huang, Xiaolong
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 7.1724 ± 0.0003 Å
• b: 11.2452 ± 0.0007 Å
• c: 18.526 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1494.22 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.0447
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No