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. Author manuscript; available in PMC: 2018 Feb 24.
Published in final edited form as: J Nat Prod. 2017 Jan 27;80(2):551–559. doi: 10.1021/acs.jnatprod.6b01146

Table 4.

Experimental and Calculated 13C NMR Data for Compounds 2, 3a, and 3b

no. 2
3
3a
3b
exptl calcd error exptl calcd error calcd error
1 130.0 131.0 1.0 131.7 1.7
2 87.6 90.2 2.6 105.9 112.4 6.5 106.6 0.7
3 148.0 148.6 0.6 148.5 0.5
4 44.3 45.9 1.6 134.2 139.3 5.1 137.3 3.1
5 31.8 32.4 0.6 148.0 148.5 0.5 147.8 −0.2
6 84.5 88.6 4.1 105.9 102.9 −3.0 101.8 −4.1
7 124.9 121.9 −3.0 31.9 36.4 4.5 40.4 8.5
8 124.5 122.2 −2.3 139.4 145.2 5.8 159.8 20.4
9 108.8 109.7 0.9
10 160.5 161.8 1.3 153.1 155.3 2.2 155.2 2.1
11 102.6 100.5 −2.1
12 143.7 146.0 2.3 140.5 140.8 0.3 117.2 −23.3
13 154.0 154.0 0
14 153.5 152.5 −1.0
2-CH3 20.0 21.9 1.9
3-OCH3/10-OCH3 55.2 53.0 −2.2 56.0 53.7 −2.3 53.8 −2.2
5-OCH3/13-OCH3 52.2 51.0 −1.2 56.0 56.2 0.2 54.3 −1.7
15-OCH3 51.9 51.3 −0.6