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. 2014 Sep 15;94(2):272–289. doi: 10.1111/mmi.12755

Table 1.

NMR data (δ, ppm; Varian INOVA 500 MHz, 25°C) for the C. difficile 630 glycopeptide

H/C 1 H/C 2 H/C 3 H/C 4 H/C 5 H/C 6 Me
GlcNAc 4.65 3.85 4.17 3.63 3.51 3.79; 3.93
100.1 55.6 79.9 70.5 76.6 61.6
N-Me-l-Thr 3.52 4.51 1.41 2.76
172.0 70.5 73.0 19.6 33.9

Exact mass of glycosyl cation 398.109035.

NAc signals C-1 176.1; H/C-2 2.08/23.8 ppm. 31P at −0.5 ppm.