Information card for entry 8101192

Structure parameters

• Formula: C26 H36 N2 O10
• Calculated formula: C13 H18 N O5
• SMILES: [C@@H]1([C@@H](CO[C@H](O1)C)OC(=O)C)C1=NO[C@@H]([C@H]1NC(=O)OC(C)(C)C)[C@H](COC(=O)C)OCc1ccccc1
• Title of publication: Crystal structure of (+)-(4S,5R,2'R,4'S,5'R,1''S)-5-(2''-acetoxy-1''- benzyloxyethyl)-3-(5'-acetoxy-2'-methyl-1',3'-dioxan-4'-yl)-4-(tert- butoxycarbonylamino)-4,5-dihydroisoxazole, C~26~H~36~N~2~O~10~
• Authors of publication: Henkel, Sonja; Fengler-Veith, Marion; Jäger, Volker
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 1
• Pages of publication: 133 - 134
• a: 5.155 ± 0.001 Å
• b: 20.146 ± 0.006 Å
• c: 13.494 ± 0.002 Å
• α: 90°
• β: 93.21 ± 0.02°
• γ: 90°
• Cell volume: 1399.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0731
• Weighted residual factors for significantly intense reflections: 0.191
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No