Information card for entry 4020917

Structure parameters

• Formula: C26 H33 N O5
• Calculated formula: C26 H33 N O5
• SMILES: O(C(=O)[C@@H](O)[C@@H](N(=O)=O)Cc1ccccc1)[C@H]1[C@H](C(c2ccccc2)(C)C)CC[C@H](C1)C
• Title of publication: Asymmetric Nitroaldol Reaction. Synthesis of Taxotere Side Chain and (-)-Bestatin Using (1R)-8-Phenylmenthyl Glyoxylate
• Authors of publication: Iwona Kudyba; Jerzy Raczko; Janusz Jurczak
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 2844 - 2850
• a: 9.561 ± 0.0019 Å
• b: 11.203 ± 0.002 Å
• c: 11.353 ± 0.002 Å
• α: 90°
• β: 94.61 ± 0.03°
• γ: 90°
• Cell volume: 1212.1 ± 0.4 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No