Information card for entry 2100887

Structure parameters

• Formula: C28 H40 O12
• Calculated formula: C28 H40 O12
• SMILES: O[C@@H]([C@@H]([C@H]([C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)C)O)O)[C@H]1O[C@H]2[C@@H]([C@H]1OCc1ccccc1)OC(O2)(C)C
• Title of publication: Structure of precursors of higher-carbon sugars
• Authors of publication: Ciunik, Z.; Jarosz, S.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 101 - 107
• a: 8.912 ± 0.001 Å
• b: 10.154 ± 0.002 Å
• c: 32.704 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2959.5 ± 0.8 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No