Information card for entry 1555176

Structure parameters

• Chemical name: Epicorpenoid A
• Formula: C18 H26 O6
• Calculated formula: C18 H26 O6
• SMILES: O1[C@@]23[C@@H](O)[C@@H]4CC(C)(C)C[C@@H]4[C@@]4([C@H]3[C@@](O[C@@H]2C[C@@H]1C(=O)O)(O)C4)C
• Title of publication: Polyoxygenated meroterpenoids and a bioactive illudalane derivative from a co-culture of Armillaria sp. and Epicoccum sp.
• Authors of publication: Li, Hong-Tao; Tang, Linhuan; Liu, Tao; Yang, Ruining; Yang, Yabin; Zhou, Hao; Ding, Zhong-Tao
• Journal of publication: Organic Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 6
• Journal issue: 23
• Pages of publication: 3847
• a: 20.3875 ± 0.0007 Å
• b: 20.3875 ± 0.0007 Å
• c: 7.4174 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2669.99 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 170
• Hermann-Mauguin space group symbol: P 65
• Hall space group symbol: P 65
• Residual factor for all reflections: 0.0256
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0852
• Goodness-of-fit parameter for all reflections included in the refinement: 0.831
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No