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2O)
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48
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27744480015
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note
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12]
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49
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27744454568
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note
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sat, was also fitted.
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note
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[5b]
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56
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85086810929
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The weak dimerization of 2b may also be partly due to steric repulsion between the N-alkyl groups and the carbonyl oxygen atoms of its a-amino acids. Such effects have been observed in computational studies of conformations of model peptides. See: D. Möhle, H.-J. Hofman, J. Pept. Res. 1998, 50, 19-28.
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-1 at the temperature at which the NMR signals coalesced, that is, at 348 K.
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58
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27744575546
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note
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Crystallization of 2b from chloroform by vapor-phase equilibration with hexane afforded crystals in which 2b had a bowl-shaped structure and was not dimerized, a result in keeping with 2b being more flexible than the corresponding cyclohexapeptide.
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-
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59
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27744516851
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-
note
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Van der Waals volumes were estimated for the spherical volume for which the radius was the distance measured from the dimer centroid to the closer hydrogen atom attached to C2.
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60
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[12b]
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61
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0004048804
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University of Utrecht, The Netherlands
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[12b]
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64
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27744448025
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note
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1H NMR and NOE experiments with different relaxation times allowed the rate of interconversion at room temperature to be estimated as 1.5-10.0 ms.
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65
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