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. 2021 Nov 2;12:734671. doi: 10.3389/fphar.2021.734671

TABLE 3.

1H (600 MHz) and 13C (150 MHz) NMR data for compound 3 (CDCl3).

Position δ H (J in Hz) δ C, type HMBC NOESY 1H-1H COSY
1 3.09 m 85.1, CH 1-OCH3 H-3β, H-10, 1-OCH3 H-2α, β
2.27 m 26.2, CH2 H-1, H-2β, H-3α, β
1.93 m H-1, H-2α, H-3α, β
1.70 m 35.1, CH2 H-18α H-2α, β, H-3β
1.65 m H-1, H-5 H-2α, β, H-3α
4 39.3, C
5 2.09 d (6.6) 45.5, CH H-3β, H-18α, β H-6
6 4.10 d (6.6) 82.3, CH C-4, C-8, C-17, 6-OCH3 H-9, 6-OCH3 H-5, H-7
7 3.00 brs 45.5, CH C-9, C-11, C-15 H-15, 6-OCH3 H-6
8 83.7, C
9 2.92 m 44.4, CH C-12, C-13, C-15 H-6 H-10, H-14
10 2.20 m 42.1, CH H-1, H-14 H-9, H-12
11 49.9, C
12α 3.06 m 39.3, CH2 C-11 H-10, H-12β
12β 1.89 m H-14 H-10, H-12α
13 76.2, C
14 4.92 d (4.8) 77.9, CH C-8, C-16, ArC = O H-10, H-12β H-9
15 6.53 d (9.9) 125.4, CH C-9, C-13 H-7, H-17 H-16
16 6.05 d (9.9) 137.3, CH C-8 H-17 H-15
17 3.03 brs 62.8, CH C-6, C-8, C-11 H-15, H-16, H-21, H-22
18α 3.26 d (8.82) 80.5, CH2 C-3, 18-OCH3 H-3α, H-5, H-19α, β, 18-OCH3 H-18β
18β 3.65 d (8.82) C-3, C-19, 18-OCH3 H-5, H-19β, 18-OCH3 H-18α
19α 2.52 m 53.8, CH2 H-18α H-19β
19β 2.56 m H-18α, β H-19α
21α 2.50 m 49.3, CH2 H-17 H-22
21β 2.53 m H-17 H-22
22 1.05 brs 13.3, CH3 H-17 H-21α, β
1-OCH3 3.24 s 56.1, CH3 C-1 H-1
6-OCH3 3.15 s 57.4, CH3 C-6 H-6, H-7
18-OCH3 3.27 s 59.2, CH3 C-18 H-18α, β
8-C=O 169.6, C
CH3 1.39 s 21.8, CH3 8-C=O H-2′, 6′
ArC = O 166.6, C
1′ 122.4, C
2′, 6′ 7.94 d (6.96) 131.7, CH C-4′, ArC = O 8-CO-CH3 H-3′, 5′
3′, 5′ 6.88 d (6.96) 113.7, CH C-1′, C-4′ 4′-OCH3 H-2′, 6′
4′ 163.6, C
4′-OCH3 3.85 s 55.4, CH3 C-4′ H-3′, 5′