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Table 1 1H and 13C NMR data of 2-ethoxystypandrone (1)(1H 400MHz, 13C 100MHz in acetone-d6)

From: 2-Ethoxystypandrone, a novel small-molecule STAT3 signaling inhibitor from Polygonum cuspidatum, inhibits cell growth and induces apoptosis of HCC cells and HCC Cancer stem cells

No

13C

δ (ppm)

1H

δ (ppm)

HMBC

(1H → 13C)

1

178.2(C)

 

H-8; H-3

2

160.4(C)

 

H-3; H-14

3

109.2(CH)

6.25 (s)

 

4

190.6(C)

 

H-3

5

157.2(C)

  

6

130.5(C)

 

H-12; H-13; H-8

7

142.6(C)

 

H-8; H-13

8

120.3(CH)

7.44 (s)

H-13

9

136.0(C)

  

10

112.0(C)

 

H-3; H-8

11

201.6(C)

 

H-12

12

30.5(CH3)

2.55 (s)

 

13

18.5(CH3)

2.35 (s)

H-8

14

65.3(CH2)

4.22(q, J = 7.0 Hz)

H-15

15

12.9(CH3)

1.48(t, J = 7.0 Hz)

H-14