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. 2023 Jun 19;31(8):101677. doi: 10.1016/j.jsps.2023.06.010

Table 3.

1D and 2D NMR data of IN1 (Avicularin).

Position 13C
HSQC
HMBC
COSY
δC δH (J in Hz) 1H→13C 1H↔1H
1
2 149.9
3 135.6
4 179.4
5 162.9
6 99.8 6.19 (1H, d, 2.1) C-5, C-7, C-8, C-10 H-6, H-8
7 165.9
8 94.7 6.38 (1H, d, 2.1) C-6, C-7, C-9, C-10 H-8, H-6
9 158.37
10 105.6
1′ 123.0
2′ 117.4 7.75 (1H, d, 2.2) C-2, C-1′, C-3′, C-4′ H-2′, H-6′
3′ 145.9
4′ 158.6
5′ 116.1 6.86 (1H, d, 8.45) C-2, C-3′, C-6′ H-5′, H-6′
6′ 122.8 7.57 (1H, dd, 2.2, 2.2) C-2, C-2′, C-4′ H-6′, H-5′, H-2′
1″ 104.6 5.15 (1H, d, 6.6) C-3, C-4″ H-1″, H-2″
2″ 72.8 3.9 (1H, t, 7.15) C-1″, C-3″ H-2″, H-1″, H-3″, H-5″
3″ 74.1 3.65 (1H, dd, 3.25, 3) H-3″, H-2″, H-5″
4″ 66.9 3.45 (1H, dd, 3.15, 3.2) C-1″, C-3″ H-4″, H-5″
5″ 69.1 3.83 (2H, dd, 3.7, 3.75) C-1″, C-3″ H-5″, H-2″, H-4″, H-3″

d, duplet; dd, duplet of duplet; t, triplet.