Information card for entry 1565111

Structure parameters

• Formula: C26 H32 O10
• Calculated formula: C26 H32 O10
• SMILES: O1C2=C(O[C@@H]3OC(=O)[C@]4([C@@H]3[C@]2(C(=O)OC)[C@]2([C@@H](O)[C@@H]1[C@@]1(OC(=O)CC1=C([C@@H]2C4)C)C(O)(C)C)C)C)C
• Title of publication: Talaromynoids A-I, Highly Oxygenated Meroterpenoids from the Marine-Derived Fungus <i>Talaromyces purpureogenus</i> SCSIO 41517 and Their Lipid Accumulation Inhibitory Activities.
• Authors of publication: Huang, Zhong-Hui; Liang, Xiao; Li, Chan-Juan; Gu, Qiong; Ma, Xuan; Qi, Shu-Hua
• Journal of publication: Journal of natural products
• Year of publication: 2021
• Journal volume: 84
• Journal issue: 10
• Pages of publication: 2727 - 2737
• a: 8.2185 ± 0.0002 Å
• b: 8.4465 ± 0.0002 Å
• c: 10.2022 ± 0.0003 Å
• α: 112.706 ± 0.003°
• β: 95.017 ± 0.002°
• γ: 110.165 ± 0.002°
• Cell volume: 593.06 ± 0.03 ų
• Cell temperature: 106 ± 9 K
• Ambient diffraction temperature: 106 ± 9 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0253
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0647
• Weighted residual factors for all reflections included in the refinement: 0.0648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No