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. 2013 Mar 1;18(3):2769–2777. doi: 10.3390/molecules18032769

Table 1.

13C-NMR (125 MHz), 1H-NMR (500 MHz), HMQC, HMBC and NOESY data of cryptolepinone (8) (DMSO-d6, δ ppm).

HMQC HMBC NOESY
2 J (HInline graphic C) 3 J (HInline graphicC) (H↔H)
δC δH
1 124.99 8.44 (dd, 1H, J = 8.1 and 1.4 Hz) C-11a C-11 C-4a H-2
2 120.04 7.35 (ddt, 1H, J = 8.1; 7.3 and 0.8 Hz) C-1 C-4 C-11a H-1/H-3
3 130.71 7.77 (ddt, 1H, J = 8.7; 7.3 and 1.4 Hz) C-4 C-1 C-4a H-2/H-4
4 115.13 7.95 (brd, 1H, J = 8.7 Hz) C-2 C-11a H-3
4a 139.73 -
5 - -
5a 129.89 -
6 122.45 8.38 (brd, 1H, J = 8,4 Hz) C-6a C-8 C-9a H-7
6a 115.70 -
7 118.62 7.20 (ddt, 1H, J = 8.4; 7.6 and 1.0 Hz) C-6 C-8 C-9 C-6a H-6/H-8
8 126.54 7.47 (ddt, 1H J = 8.3; 7.6 and 1.0 Hz) C-6 C-9a H-7/H-9
9 112.36 7.57 (brd, 1H J = 8.3 Hz) C-6a C-7 H-8
9a 138.25 -
10 (N-H) - 11.89 (s, 1H) C-10a C-9a
10a 123.03 -
11 166.45 -
11a 122.90 -
N-CH3 35.41 4.36 (s, 3H) C-4a C-5a H-4/H-6