Information card for entry 1502411

Structure parameters

• Formula: C32 H30 O14
• Calculated formula: C32 H30 O14
• SMILES: COC(=O)[C@@]1([C@H]2OC(=O)CC2)Oc2c(c(C)cc(O)c2C(=O)C1)c1c2O[C@@](C(=O)OC)([C@H]3OC(=O)CC3)CC(=O)c2c(cc1C)O
• Title of publication: Structures of the dimeric and monomeric chromanones, gonytolides A-C, isolated from the fungus Gonytrichum sp. and their promoting activities of innate immune responses.
• Authors of publication: Kikuchi, Haruhisa; Isobe, Masato; Sekiya, Mizuki; Abe, Yuko; Hoshikawa, Tsuyoshi; Ueda, Kazunori; Kurata, Shoichiro; Katou, Yasuhiro; Oshima, Yoshiteru
• Journal of publication: Organic letters
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 17
• Pages of publication: 4624 - 4627
• a: 9.5327 ± 0.0001 Å
• b: 14.3362 ± 0.0002 Å
• c: 11.4665 ± 0.0005 Å
• α: 90°
• β: 109.175 ± 0.0008°
• γ: 90°
• Cell volume: 1480.1 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for all reflections included in the refinement: 0.2288
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No