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. 2016 Apr 26;21(5):549. doi: 10.3390/molecules21050549

Table 2.

1H, 13C, HMBC and NOESY correlation data for tokinolide C (7) a.

Position δc, Type δH, (J in Hz) HMBC (H → C) NOESY
1 168.7, qC
3 148.9, qC
3a 153.5, qC
4 19.0, CH2 2.21 m, 2.57 m 3, 5, 6, 3a, 7a 8, 9
5 21.9, CH2 1.98 m 6, 3a 6, 4′
6 37.1, CH 2.99 dt (10.4, 8.5) 5, 7, 3a′ 5, 4′, 7′
7 37.0, CH 3.39 d (8.5) 6, 3a, 7a, 7a′
7a 124.5, qC
8 112.2, CH 5.24 t (7.9) 3, 3a, 10 4, 9, 10, 11
9 27.2, CH2 2.37 m 3, 8, 10, 11 4, 8, 10, 11
10 22.34, CH2 1.51 m 8, 9, 11 8, 9, 11
11 13.56, CH3 0.96 t (7.4) 9, 10 8, 9, 10
1′ 176.9, qC
3′ 153.4, qC
3a′ 48.5, qC
4′ 24.1, CH2 1.77 m, 1.88 m 6, 3′, 6′, 7a′ 6′, 7′, 8′, 6, 5
5′ 20.6, CH2 1.86 m 3a′, 4′, 6′ 8′
6′ 133.8, CH 6.11 ddd (9.9) 4′, 5′, 7a′ 4′, 7′
7′ 121.0, CH 5.77 dd (1.7, 9.9) 4′, 3a′ 4′, 6, 5
7a′ 48.3, qC
8′ 103.9, CH 4.88 t (7.9) 3′, 3a′, 10′ 4′, 9′, 10′, 11′
9′ 28.0, CH2 2.18 m 3′, 8′, 10′,11′ 8′, 10′, 11′
10′ 22.6, CH2 1.44 m 8′, 9′, 11′ 8′, 9′, 11′
11′ 13.7, CH3 0.92 t (7.4) 9′, 10′ 8′, 9′, 10′

a Data obtained on a Varian 600 MHz instrument in CDCl3.