Information card for entry 4517739

Structure parameters

• Formula: C15 H16 O10
• Calculated formula: C15 H15.5 O10
• SMILES: O1c2c(c(O)cc(O)c2)C(=O)[C@H](O)[C@H]1c1cc(O)c(O)c(O)c1.O[C@@H]1C(=O)c2c(O[C@H]1c1cc(O)c(O)c(O)c1)cc(O)cc2O.O.O.O.O
• Title of publication: New Method for Extracting and Purifying Dihydromyricetin from <i>Ampelopsis grossedentata</i>.
• Authors of publication: Hu, Hongchao; Luo, Fan; Wang, Mingjie; Fu, Zhihuan; Shu, Xugang
• Journal of publication: ACS omega
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 23
• Pages of publication: 13955 - 13962
• a: 15.3733 ± 0.0001 Å
• b: 7.8961 ± 0.0001 Å
• c: 24.1511 ± 0.0002 Å
• α: 90°
• β: 92.627 ± 0.001°
• γ: 90°
• Cell volume: 2928.6 ± 0.05 ų
• Cell temperature: 100 ± 0.17 K
• Ambient diffraction temperature: 100 ± 0.17 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No