TABLE 3.
No. | X5-Me
|
X6-Me
|
|||
---|---|---|---|---|---|
13C-NMR (δ [ppm]) | 1H-NMR (δ [ppm]), J (Hz)b | HMBC | 13C-NMR (δ [ppm]) | 1H-NMR (δ [ppm]), J (Hz)b | |
1 | 130.3 | 7.47 dq (11.5, 0.9) | C3, C5, C19 | 138.3 | 7.55 d (7.8) |
2 | 119.0 | 6.95 d (11.5) | C3, C4, C10 | 123.0 | 7.89 d (7.8) |
3 | 149.4 | 145.0 | |||
4 | 163.6 | 166.1 | |||
5 | 202.2 | 160.7 | |||
6 | 35.4 | 3.01 ddd (17.5, 6.9, 6.9) | C5, C7, C8 | 33.2 | 3.10 ddd (14.2, 8.8, 6.4) |
2.82 ddd (17.5, 7.3, 7.3) | C5, C7, C8 | 2.84 ddd (14.2, 9.3, 7.3) | |||
7 | 21.3 | 1.85 m | C5 | 24.8 | 1.93 m |
8 | 49.2 | 2.55 m | 49.4 | 2.69 ddd (11.7, 7.3, 3.9) | |
9 | 211.5 | 211.2 | |||
10 | 139.8 | 136.0 | |||
11 | 37.5 | 2.50 m | C9, C12, C13 | 37.5 | 2.50 ddd (15.6, 13.2, 6.4) |
2.44 m | C9, C12, C13 | 2.42 ddd (15.6, 6.4, 2.4) | |||
12 | 30.4 | 2.01 ddd (13.3, 6.0, 2.3) | 30.6 | 2.00 ddd (13.2, 6.4, 2.4) | |
1.68 ddd (13.3, 12.8, 6.4) | C18 | 1.68 ddd (13.2, 13.2, 6.4) | |||
13 | 47.6 | 47.6 | |||
14 | 49.6 | 1.84 m | 49.6 | 1.89 m | |
15 | 22.2 | 2.10 m | C17 | 22.3 | 2.10 m |
1.85 m | 1.85 m | ||||
16 | 36.1 | 2.59 dd (19.3, 7.8) | C17 | 36.2 | 2.58 dd (19.1, 8.3) |
2.24 ddd (19.3, 9.2, 9.2) | C17 | 2.23 ddd (19.1, 9.3, 8.8) | |||
17 | 218.7 | 218.2 | |||
18 | 13.5 | 1.18 s | C12, C13, C14, C17 | 13.5 | 1.17 s |
19 | 12.2 | 1.95 d (0.9) | C1, C5, C10 | 19.0 | 2.47 s |
3-OMe | 60.8 | 3.86 s | C3 | ||
COOMe | 52.4 | 3.85 s | C4 | 52.6 | 3.97 s |
The molecular formula and weight of X5-Me and X6-Me are C12H28O6 and 376 and C20H25NO4 and 343, respectively. In HMBC data, carbons showing cross peaks with the proton are in the same row.
Abbreviations for NMR: s, singlet; d, doublet; q, quartet, m, multiplet.