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. 2022 Jul 9;20(7):449. doi: 10.3390/md20070449

Table 1.

1H (700 MHz) and 13C NMR (176 MHz) data for 1 and 2 in DMSO-d6.

Position 1 2
δC, Type δH, Mult (J Hz) δC, Type δH, Mult (J Hz)
1 115.3, C 117.3, C
2 127.5, C 128.0, C
3 137.6, C 136.1, C
4 137.0, C 136.4, C
5 109.4, CH 7.37, d (8.6) 108.6, CH 7.30, d (8.5)
6 124.0, CH 7.57, d (8.6) 123.6, CH 7.58, d (8.5)
7 168.6, C 169.2, C
8-NH 10.94, br s 10.97, br s
9 171.3, C 174.5, C
10 23.6, CH3 2.21, s 29.8, CH2 2.49, overlapping
11 9.8, CH3 1.17, t (7.6)
12-NH 8.94, s 8.84, s
14 144.2, C 143.3, C
15 196.3, C 196.2, C
16 8.1, CH3 2.00, s 7.9, CH3 1.99, s
17 24.2, CH3 2.40, s 24.1, CH3 2.40, s
3-OH 10.18, br s n.d.
1-COOH 13.00, br s 13.09, br s

“n.d.”: not detection. Data were recorded on a Bruker Avance 700 MHz NMR spectrometer in DMSO-d6 with TMS as an internal standard. The signals were assigned with the aid of 1H-1H COSY, HSQC, and HMBC data.