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. 2018 Dec 19;16(12):519. doi: 10.3390/md16120519

Table 1.

1H (500 MHz) and 13C (125 MHz) NMR data of compound 1 (CD3OD, δ: ppm).

No. δC (type) δH (mult., J in Hz) No. δC (type) δH (mult., J in Hz)
δ-Cl-DHPA1 N-Me-Ile4
CO 170.4, C CO 172.1, C
α 70.7, CH 5.21, t (7.0) α 56.9, CH 5.09, d (11.0)
β 34.9, CH2 2.18, m β 33.4, CH 2.06, m
γ 67.2, CH 3.82, m β-Me 14.8, CH3 0.90, overlapped
δ 48.3, CH2 3.61, d (5.0) γ 25.3, CH2 1.50, m; 1.07, m
β-Me-Pro2 δ 10.0, CH3 0.94, overlapped
CO 172.4, C N-Me 30.1, CH3 3.21, s
α 67.5, CH 4.08, m N-Me-Ala5
β 37.5, CH 2.55, m CO 170.8, C
γ 30.6, CH2 2.10, m; 1.77, br s α 55.4, CH 5.32, q (6.5)
δ 45.4, CH2 4.06, m; 3.95, m β 14.3, CH3 1.32, overlapped
β-Me 17.9, CH3 1.16, d (6.8) N-Me 27.5, CH3 2.71, s
Ile3 β-Ala6
CO 173.6, C CO 173.6, C
α 53.4, CH 4.76, overlapped α 33.8, CH2 2.69, m; 2.58, m
β 37.0, CH 1.94, m β 33.4, CH2 3.80, m; 3.15, m
β-Me 14.3, CH3 0.86, overlapped NH 8.56, br. s
γ 24.6, CH2 1.49, m;1.33, overlapped
δ 9.7, CH3 0.87, overlapped
NH 7.03, d (7.8)