Skip to main content
. 2022 Jan 18;20(2):83. doi: 10.3390/md20020083

Table 1.

1H, 13C, and 15N NMR data for ligiamycins A (1) and B (2) in DMSO-d6.

Ligiamycin A (1) a Ligiamycin B (2) b
Position δC/δN, Type δH, Mult (J in Hz) δC, Type δH, Mult (J in Hz)
1 165.1, C 165.2, C
1’ 169.8, C 169.9, C
2 157.8, C 157.8, C
3 98.7, C 98.7, C
4 200.0, C 200.0, C
5 50.1, C 50.1, C
6 39.3, CH 1.55, t (10.0) 39.6, CH 1.56, t (10.0)
7a 27.2, CH2 1.88, m 26.8, CH2 1.92, m
7b 0.88, m c 0.86, m
8a 35.7, CH2 1.70, m 30.3, CH2 1.75, m
8b 1.00, ddd (16.0, 12.5, 3.5) 0.99, m
9 32.9, CH 1.48, m 40.9, CH 1.47, m
10a 42.1, CH2 1.77, m 36.8, CH2 1.84, m
10b 0.78, m 0.76, m
11 38.0, CH 1.75, m 37.7, CH2 1.73, m
12 129.0, CH 5.31, dd (10.0, 2.0) 129.1, CH 5.33, dd (10.0, 2.0)
13 130.2, CH 5.52, m 130.2, CH 5.52, m
14 34.6, CH 3.06, m 34.6, CH 3.06, m
15 14.8, CH3 1.27, s 14.8, CH3 1.28, s
16 22.5, CH3 0.88, m c 66.5, CH2 3.22, d (6.0)
17 18.5, CH3 0.68, d (7.0) 18.5, CH3 0.68, d (6.5)
1,1’-NH 146.8 d, NH 10.6, br s 10.6, br s
2-NH2a 103.9 d, NH2 9.16, s 9.16, s
2-NH2b 8.90, br s 8.89, br s
16-OH 4.36, br s

a 1H and 13C NMR data were recorded at 800 and 200 MHz, respectively. b 1H and 13C NMR data were recorded at 850 and 225.5 MHz, respectively. c Overlapping signals. d The chemical shifts of 15N in the groups of N were determined based on the 1H-15N HSQC NMR spectrum.