Information card for entry 7159212

Structure parameters

• Common name: glucominiotone B
• Formula: C19 H22 O9
• Calculated formula: C19 H22 O9
• SMILES: O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc1c(c(O)cc2c1cc(c(O)c2)C(=O)C)C)CO
• Title of publication: Antimicrobial polyketides and sesquiterpene lactones from the deep-sea cold-seep-derived fungus <i>Talaromyces minioluteus</i> CS-113 triggered by the histone deacetylase inhibitor SAHA.
• Authors of publication: Yang, Sui-Qun; Song, Qi; Li, Xiao-Ming; Li, Xin; Li, Hong-Lei; Meng, Ling-Hong; Wang, Bin-Gui
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2023
• Journal volume: 21
• Journal issue: 12
• Pages of publication: 2575 - 2585
• a: 6.671 ± 0.0002 Å
• b: 16.5087 ± 0.0005 Å
• c: 18.4122 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2027.73 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0584
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1428
• Weighted residual factors for all reflections included in the refinement: 0.1449
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No