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. 2016 Oct 12;21(10):1344. doi: 10.3390/molecules21101344

Table 1.

1H-NMR (500 MHz) and 13C-NMR (125 MHz) data for 1, 1a, 1b, and 2 (δ ppm).

No. 1 a 1a b 2 a
δH (J in Hz) δC δH (J in Hz) δC δH (J in Hz) δC
1 42.5 46.1 42.5
1.74 (d, 15.5) 34.0 1.63 (d, 15.0) 33.6 1.64 (d, 15.5) 33.3
2.45 (dd, 2.5, 15.5) 2.40 (dd, 3.5, 15.0) 2.46 (dd, 3.5, 15.5)
3 4.72 (m) 80.2 4.63 (m) 79.6 4.68 (m) 79.7
4 2.02 (m) 51.5 1.96 (m) 51.5 2.02 (m) 51.4
5 2.35 (m) 45.5 2.27 (m) 45.5 2.50 (m) 45.0
6 2.36 (m) 41.7 2.26 (m) 41.3 2.39 (d, 3.0) 49.1
7 1.25 (s) 31.9 1.15 (s) 31.7 1.28 (s) 32.7
8 1.83 (m) 25.0 1.76 (m) 24.8 1.81 (m) 25.3
9 0.99 (d, 6.0) 19.3 0.96 (d, 6.0) 19.6 0.99 (d, 6.5) 19.8
10 1.01 (d, 6.0) 20.0 0.98 (d, 6.0) 20.7 1.03(d, 6.5) 20.9
11α 2.31 (m) 34.2 2.31 (m) 34.7 4.45 (m) 81.9
11β 2.23 (m) 2.02 (m)
12α 4.90 (t, 7.5) 79.4 4.77 (t, 7.4) 81.7 2.75 (m) 39.4
12β 2.92 (dd, 8.0, 18.5)
13 158.2 156.4 156.3
14a 5.21 (d, 1.5) 111.5 5.19 (d, 1.5) 112.9 4.91 (d, 8.0) 106.1
14b 5.42 (d, 1.5) 5.44 (d, 1.5) 4.88 (d, 8.0)
15 180.6 179.0 178.6
1′ 4.35 (d, 7.5) 101.5 4.56 (d, 8.0) 100.4 4.33 (d, 7.5) 102.4
2′ 3.22 (m) 73.5 4.96 (m) 75.1 3.27 (s) 73.5
3′ 3.40 (m) 76.6 5.18 (t, 10.0) 73.2 3.44 (m) 76.4
4′ 3.39 (m) 70.2 5.05 (t, 10.0) 68.5 3.44 (m) 69.7
5′ 3.29 (m) 76.2 3.68 (m) 71.9 3.29 (m) 75.7
6′a 3.87 (dd, 2.5, 12.0) 61.6 4.26 (dd, 5.0, 12.0) 62.2 3.87 (dd, 3.0,12.0) 61.6
6′b 3.75 (dd, 5.5, 12.0) 4.12 (dd, 2.0, 12.0) 3.78 (dd, 3.0,12.0)
2′-Ac 2.03 (s) 169.0/20.7
3′-Ac 1.99 (s) 170.8/20.8
4′-Ac 2.01 (s) 169.3/20.7
6′-Ac 2.08 (s) 170.6/20.6

a,b: Data were recorded in MeOH-d4, and CDCl3, respectively.