Information card for entry 4020490

Structure parameters

• Formula: C30 H46 O7
• Calculated formula: C30 H46 O7
• SMILES: c1(ccccc1)CO[C@@H]1[C@H]2[C@H]([C@H](CO1)O)O[C@@]([C@@](C)(O2)OCC1CCCCC1)(C)OCC1CCCCC1
• Title of publication: Arabinose-Derived Ketones as Catalysts for Asymmetric Epoxidation of Alkenes
• Authors of publication: Tony K. M. Shing; Gulice Y. C. Leung; To Luk
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 7279 - 7289
• a: 9.6976 ± 0.0019 Å
• b: 10.401 ± 0.002 Å
• c: 14.886 ± 0.003 Å
• α: 74.6 ± 0.03°
• β: 85.88 ± 0.03°
• γ: 80.69 ± 0.03°
• Cell volume: 1427.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No