Information card for entry 1519612

Structure parameters

• Common name: Schizine A
• Formula: C24 H25 N O5
• Calculated formula: C24 H25 N O5
• SMILES: C12=N[C@H](C(=O)O[C@H]1CC([C@@H]1CC=C3[C@H]4[C@@]21C(=O)O[C@H]4OC3)(C)C)Cc1ccccc1
• Title of publication: Iminolactones from Schizophyllum commune.
• Authors of publication: Liu, Xuemei; Frydenvang, Karla; Liu, Huizhen; Zhai, Lin; Chen, Ming; Olsen, Carl Erik; Christensen, Søren Brøgger
• Journal of publication: Journal of natural products
• Year of publication: 2015
• Journal volume: 78
• Journal issue: 5
• Pages of publication: 1165 - 1168
• a: 8.713 ± 0.0006 Å
• b: 11.51 ± 0.0008 Å
• c: 20.253 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2031.1 ± 0.2 ų
• Cell temperature: 122 ± 1 K
• Ambient diffraction temperature: 122 ± 1 K
• Number of distinct elements: 4
• 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: 0.0431
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No