Information card for entry 4020285

Structure parameters

• Formula: C22 H29 N O7
• Calculated formula: C22 H29 N O7
• SMILES: O(C(=O)[C@H]1N([C@@H]2[C@H](C1)CC[C@H]2[C@@H](O)c1cc2OCOc2cc1)C(=O)OC(C)(C)C)C
• Authors of publication: Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 5070 - 5085
• a: 7.8553 ± 0.0001 Å
• b: 12.6178 ± 0.0002 Å
• c: 21.7682 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2157.59 ± 0.05 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No