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. 2024 Aug 2;9(32):34869–34879. doi: 10.1021/acsomega.4c04403

Table 2. 1H and 13C NMR Spectroscopic Data for Compounds 4 and 5a.

  4 5
no. δH (mult) δC δH (mult) δC
1 2.12 m 26.1 2.17 dt (9.1, 4.9) 28.5
2 1.08 m 14.4 1.19 m 15.4
  0.67 m   0.63 m  
3 2.36 m 28.1 1.96 m 26.6
4   91.1   151.3
5   159.0   135.4
6   127.3   151.4
7   143.8   129.7
8   198.6   197.1
9 3.86 s 78.0 3.97 s 83.2
10   50.5   57.6
11   128.9   65.4
12   170.6   172.0
13 1.80 s 21.7 1.37 s 19.0
14 1.00 s 15.6 1.15 s 14.8
15 3.04 m 37.2 2.28 dd (17.9, 9.5) 29.2
      2.94 dd (18.0, 7.2)  
1′ 1.57 m 27.6 1.63 m 26.6
2′ 0.88 m 10.4 0.64 m 10.4
  1.20 m   1.19 m  
3′ 1.78 m 23.1 1.64 m 29.7
4′   77.5   78.7
5′ 2.69 m 56.1 1.57 dd (14.2, 2.8) 56.5
6′ 2.60 m 24.5 2.52 dd (14.5, 7.2) 28.2
  2.57 m   1.72 d (14.3)  
7′   125.6   59.1
8′   87.8   95.5
9′ 1.78 m 54.3 2.63 dd (9.5, 7.2) 52.1
10′   45.3   43.1
11′   166.5   146.1
12′   172.4   168.4
13′ 5.09 d (13.5) 8.5 5.50 brs 122.9
  4.77 d (13.5)   6.18 brs  
14′ 0.96 s 27.7 0.93 s 24.0
15′ 4.04 d (12.0) 69.4 4.30 d (11.1) 70.4
  4.01 d (12.0)   4.07 d (11.1)  
1″   171.6   166.0
2″ 5.90 m 111.7 5.90 m 114.4
3″   161.1   154.1
4″ 4.18 d (15.0) 67.4 4.60 m 67.3
  4.14 d (15.0)      
5″ 2.10 s 16.0 2.12 s 16.0
6″   170.1   171.7
7″ 2.72 m 29.2 2.68 m 28.9
8″ 2.61 m 28.8 2.73 m 29.0
9″   173.1   172.8
6″-OEt 4.11 q (7.5) 61.5    
  1.25 t (7.5) 29.7    
12-OMe 3.78 s 53.3 3.43 s 52.1
9″-OMe     3.69 s 52.1
a

Data (1H 500 MHz, 13C 125 MHz) in CDCl3. δ: ppm, J in Hz.