Information card for entry 1502201

Structure parameters

• Formula: C13 H19 N O6
• Calculated formula: C13 H19 N O6
• SMILES: O=CN1C[C@H](CC=C)[C@](O)(C1(C(=O)OC)C(=O)OC)C
• Title of publication: Total synthesis of (-)-salinosporamide A.
• Authors of publication: Satoh, Nobuhiro; Yokoshima, Satoshi; Fukuyama, Tohru
• Journal of publication: Organic letters
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 12
• Pages of publication: 3028 - 3031
• a: 8.6606 ± 0.0004 Å
• b: 7.5271 ± 0.0004 Å
• c: 11.6989 ± 0.0005 Å
• α: 90°
• β: 109.834 ± 0.003°
• γ: 90°
• Cell volume: 717.4 ± 0.06 ų
• Cell temperature: 93.1 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 4
• 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: 0.0537
• Weighted residual factors for all reflections included in the refinement: 0.1617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No