Table 1.
position | 1 |
2 |
|||
---|---|---|---|---|---|
δC | δH (J in Hz) | HMBC | δC | δH (J in Hz) | |
1 | 37.2 | 2.82 (1H, dd, 17.9, 4.6) eq | 3b, 15 (w)a | 33.3 | 2.84 (1H, dd, 17.9, 4.4) |
2.56 (1H, dd, 17.9, 10.6) ax | 2.49 (1H, dd, 17.9, 11.7) | ||||
2 | 42.1 | 2.33 (1H, dddd, 11.4, 10.6, 4.6, 3.0) ax | 1a, 1b, 3b, 13a, 13b, 14 | 46.1 | 1.67 (1H, dddd, 12.3, 11.7, 4.4, 3.3) |
3 | 28.0 | 1.98 (1H, dddd, 11.4, 4.7, 3.0, 2.5) eq | 1a, 1b (w), 2 (w), 4a, 4b (w) | 24.6 | 2.06 (1H, m, 12.3, 3.3)b |
1.66 (1H, dddd, 11.4, 11.4, 11.4, 5.3) ax | 1.42 (1H, m, 12.6, S.4)b | ||||
4 | 38.0 | 3.08 (1H, ddd, 18.1, 11.4, 4.7) ax | 3b, 5 | 38.9 | 3.04 (1H, m, 17.6, 12.3)b |
2.95 (1H, ddd, 18.1, 5.3, 2.5) eq | 2.95 (1H, m, 17.6, S.0)b | ||||
5 | 125.7 | 7.20 (1H, s) | 1b, 4a (w), 4b | 125.6 | 7.24 (1H, s) |
6 | 159.1 | 5, 8, 1′ | 159.2 | ||
7 | 180.1 | 5, 8 | 180.1 | ||
8 | 137.4 | 7.24 (1H, s) | 15 | 137.4 | 7.28 (1H, s) |
9 | 153.8 | 1a, 1b (w), 8, 15 | 154.1 | ||
10 | 142.2 | 1a, 1b, 4a, 5, 8, 15 | 143.0 | ||
11 | 143.4 | 1a, 1b, 3b, 4a, 4b (w), 5, 8 (w) | 143.9 | ||
12 | 150.0 | 1a, 1b, 3b (w), 13a, 13b, 14 | 73.1 | ||
13 | 110.5 | 4.83c (1H, s) | 2, 14 | 27.3 | 1.27 (3H, s) |
4.81d (1H, s) | |||||
14 | 21.0 | 1.83 (3H, s) | 2, 13a, 13b | 26.8 | 1.25 (3H, s) |
15 | 27.4 | 2.40 (3H, s) | 8 | 27.4 | 2.45 (3H, s) |
glucose moiety | |||||
1′ | 101.8 | 5.00 (1H, d, 7.6) | 2′, 3′, 5′ | 101.8 | 5.02 (1H, d, 7.6) |
2′ | 74.5 | 3.57 (1H, dd, 9.2, 7.6) | 3′ | 74.5 | 3.57 (1H, dd, 9.2, 7.6) |
3′ | 77.1 | 3.51 (1H, t, 9.2) | V, 2′, 4′, 5′ | 77.1 | 3.51 (1H, t, 9.2) |
4′ | 71.6 | 3.38 (1H, t, 9.2) | 2′, 3′, 5′, 6′a, 6′b (w) | 71.6 | 3.39 (1H, t, 9.2) |
5′ | 75.9 | 3.75 (1H, ddd, 9.2, 6.7, 1.8) | 1′, 4′, 6′a (w), 6′b | 75.9 | 3.75 (1H, ddd, 9.2, 6.6, 1.6) |
6′ | 64.9 | 4.55 (1H, dd, 12.0, 1.8) | 4′, 5′ | 64.9 | 4.53 (1H, dd, 12.0, 1.6) |
4.15 (1H, dd, 12.0, 6.7) | 4.15 (1H, dd, 12.0, 6.6) | ||||
glutaryl group | |||||
1″ | 172.5 | 6′a, 6′b, 2″a, 2″b | 172.6 | ||
2″ | 46.3 | 2.74 (1H, d, 14.8) | 4″, 6″ | 46.9 | 2.68 (1H, d, 14.5) |
2.68 (1H, d, 14.8) | 2.62 (1H, d, 14.5) | ||||
3″ | 70.8 | 2″a, 2″b, 4″, 6″ | 71.0 | ||
4″ | 46.0 | 2.63 (2H, brs) | 2″a, 2″b, 6″ | 46.9 | 2.61 (2H, brs) |
5″ | 175.0 | 4″ | 175.0 | ||
6″ | 27.9 | 1.34 (3H, s) | 2″a, 2″b, 4″ | 28.0 | 1.31 (3H, s) |
w: weak.
Only identifiable couplings.
cis to Me-14.
trans to Me-14.