Information card for entry 7151025

Structure parameters

• Chemical name: 6-(2',3',4'-Tri-O-acetyl-β-L-rhamnopyranosyl)indolo[2,3-b]quinoxaline
• Formula: C26 H25 N3 O7
• Calculated formula: C26 H25 N3 O7
• SMILES: O1[C@H](n2c3ccccc3c3nc4c(nc23)cccc4)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1C
• Title of publication: Synthesis of 6H-indolo[2,3-b]quinoxaline-N-glycosides and their cytotoxic activity against human ceratinocytes (HaCaT)
• Authors of publication: Driller, Katrin Marie; Libnow, Stefanie; Hein, Martin; Harms, Manuela; Wende, Kristian; Lalk, Michael; Michalik, Dirk; Reinke, Helmut; Langer, Peter
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2008
• Journal volume: 6
• Journal issue: 22
• Pages of publication: 4218 - 4223
• a: 6.3601 ± 0.0002 Å
• b: 11.2214 ± 0.0005 Å
• c: 35.0578 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2502.05 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.051
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0832
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No