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. 2019 Dec 16;17(12):707. doi: 10.3390/md17120707

Table 1.

1H and 13C NMR data for plakinamine P (1) (CD3OD, 600 MHz).

Position. δC, Type δH (J in Hz) COSY HMBC a
1a 38.2, CH2 2.01 (ddd, 13.8, 4.1, 4.1) 1b, 2ab 3, 5, 10
1b 1.21 (ddd, 13.8, 13.8, 3.4) 1a, 2ab 19
2a 23.7, CH2 1.95 (m) 1ab, 2b, 3 1, 3, 4, 10
2b 1.62 (m) 1ab, 2a, 3 1, 3, 10
3 66.8, CH 3.21 (m) 2ab, 4ab
4a 29.7, CH2 1.84 (m) 3, 4b, 5 2, 3, 10
4b 1.51 (m) 3, 4a, 5 3, 5
5 41.9, CH 1.51 (m) 4ab, 6ab 3
6a 30.6, CH2 1.86 (m) 5, 7 7, 8
6b 1.30 (m) 5, 7 4, 5
7 118.4, CH 5.20 (br d, 2.8) 6ab 5, 6, 9, 14
8 140.7, C
9 50.5, CH 1.73 (m) 11ab 8, 11
10 35.5, C
11a 22.7, CH2 1.63 (m) 9, 11b, 12ab 8, 9
11b 1.52 (m) 9, 11a, 12ab 8, 9, 10, 13
12a 40.9, CH2 2.09 (m) 11ab, 12b 9, 11, 13, 14
12b 1.28 (m) 11ab, 12a
13 44.7, C
14 56.3, CH 1.87 (m) 15ab 7, 8, 13
15a 24.2, CH2 1.57 (m) 14, 15b, 16ab 16
15b 1.46 (m) 14, 15a, 16ab
16a 29.2, CH2 1.93 (m) 15ab, 16b, 17 13, 15
16b 1.33 (m) 15ab, 16a, 17 15, 17, 20
17 57.2, CH 1.29 (m) 16ab, 20 12, 13, 16, 18, 20, 21
18 12.4, CH3 0.59 (s) 12, 13, 14, 17
19 13.4, CH3 0.86 (s) 1, 5, 9, 10
20 38.2, CH 1.45 (m) 17, 21, 22ab 22, 23
21 19.4, CH3 1.05 (d, 6.9) 20 17, 20
22a 36.8, CH2 1.46 (m) 20, 22b, 23ab
22b 1.17 (m) 20, 22a, 23ab 20, 21
23a 28.1, CH2 2.24 (ddd, 12.7, 12.7, 4.8) 22ab, 23b 22, 24, 25, 28
23b 2.07 (m) 22ab, 23a 22, 24, 25, 28
24 159.9, C
25 36.1, CH 2.38 (sep, 6.9) 26, 27 23, 24, 26/27, 28
26 22.6, CH3 1.09 (d, 6.9) 25 24, 25, 27
27 22.4, CH3 1.10 (d, 6.9) 25 24, 25, 26
28 111.7, CH 5.31 (t, 6.9) 29ab 23, 24, 25, 29
29 56.4, CH2 3.76 (dd, 7.6, 2.1) 28, 29b 24, 28, 30/31
30 42.7, CH3 2.84 (s) 29, 30/31
31 42.7, CH3 2.84 (s) 29, 30/31
32 40.5, CH3 2.85 (s) 3, 32/33
33 40.5, CH3 2.85 (s) 3, 32/33

agHMBC correlations, optimized for 8 Hz, are from proton(s) stated to the carbons listed.