Information card for entry 4100912

Structure parameters

• Common name: Boc-Aib-Gpn-Aib-Gpn-OMe
• Formula: C32 H56 N4 O7
• Calculated formula: C32 H56 N4 O7
• SMILES: CC(C)(C)OC(=O)NC(C(=O)NCC1(CC(=O)NC(C(=O)NCC2(CC(=O)OC)CCCCC2)(C)C)CCCCC1)(C)C
• Title of publication: Supplementary Information of X-ray Crystal Analysis of HAM4
• Authors of publication: Kimihisa Yamamoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 13.7261 ± 0.0018 Å
• b: 15.372 ± 0.002 Å
• c: 17.492 ± 0.002 Å
• α: 90°
• β: 101.285 ± 0.003°
• γ: 90°
• Cell volume: 3619.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No