Table 1.
position | AT2433-A3 (1)b,c
|
AT2433-A4 (2)b,d
|
AT2433-A5 (3)b,d
|
AT2433-B3 (4)b,c
|
||||
---|---|---|---|---|---|---|---|---|
δC, type | δH, m (J in Hz) | δC, type | δH, m (J in Hz) | δC, type | δH, m, (J in Hz) | δC, type | δH, m (J in Hz) | |
1 | 112.7, CH | 7.72, d (8.0) | 112.2, CH | 7.75, d (8.0) | 112.2, CH | 7.82, dd (8.0, 1.0) | 113.1, CH | 7.69, d (7.5) |
2 | 129.2, CH | 7.64, t (7.0) | 127.6, CH | 7.61, td (7.5, 1.5) | 127.1, CH | 7.56, td (8.0, 1.0) | 128.0, CH | 7.53, td (8.0, 1.0) |
3 | 122.4, CH | 7.32, t (7.0) | 120.7, CH | 7.40, t (7.0) | 121.3, CH | 7.36, td (8.0, 1.0) | 121.6, CH | 7.32, td (8.0, 1.0) |
4 | 126.8, CH | 8.99, d (8.0) | 124.5, CH | 9.12, d (8.0) | 124.2, CH | 8.95, d (8.0) | 126.2, CH | 9.13, d (8.0) |
4a | 121.4, C | 121.0, C | 119.8, C | 123.5, C* | ||||
4b | 119.8, C | 117.5, C | 115.9, C | 119.6, C* | ||||
4c | 124.4, C | 118.2, C | 118.9, C | 119.7, C | ||||
5 | 172.2, C | 169.3, C | 169.7, C | 171.3, C* | ||||
6-CH3 | 23.9, CH3 | 3.20, s | 23.6, CH3 | 3.11, s | 24.0, CH3 | 3.24, s | ||
7 | 172.2, C | 169.5, C | 169.7, C | 171.3, C* | ||||
7a | 123.4, C | 121.9, C | 120.5, C | 119.7, C | ||||
7b | 121.4, C | 119.4, C | 115.5, C | 119.6, C | ||||
7c | 127.5, C | 125.5, C | 123.1, C | 123.5, C* | ||||
8 | 125.9, CH | 9.20, d (8.0) | 123.8, CH | 9.27, dd (8.0, 1.0) | 123.3, CH | 8.87, d (8.0) | 126.4, CH | 9.23, d (8.0) |
9 | 123.8, CH | 7.30, t (8.0) | 122.5, CH | 7.42, t (8.0) | 121.3, CH | 7.34, t (7.5) | 122.0, CH | 7.34, t (8.0) |
10 | 131.0, CH | 7.52, d (7.5) | 129.6, CH | 7.65, dd (7.5, 1.0) | 126.0, CH | 7.62, dd (7.5, 1.0) | 128.3, CH | 7.56, td (8.5, 1.5) |
11 | 118.1, C | 116.5, C | 115.8, C | 112.1, CH | 7.81, d (8.5) | |||
11a | 139.9, C | 138.2, C | 137.1, C | 142.9, C | ||||
12 | 11.95, brs | |||||||
12a | 131.8, C | 129.7, C | 128.8, C | 130.8, C | ||||
12b | 131.4, C | 130.3, C | 129.0, C | 131.6, C | ||||
13 | 11.81, brs | 11.64, brs | ||||||
13a | 141.9, C | 140.8, C | 140.1, C | 141.9, C | ||||
1′ | 86.5, CH | 7.01, d (9.5) | 83.8, CH | 6.90, d (9.0) | 86.3, CH | 6.18, d (8.5) | ||
2′ | 73.8, CH | 3.82, m | 72.1, CH | 3.41, m | 73.7, CH | 3.84, t (8.0) | ||
2′-OH | 4.94, d (5.5) | |||||||
3′ | 79.5, CH | 3.68, m | 76.6, CH | 3.51, m | 79.1, CH | 3.98, t (9.5) | ||
3′-OH | 5.28, d (6.5) | |||||||
4′ | 80.3, CH | 3.68, m | 77.0, CH | 3.67, t (9.5) | 79.6, CH | 3.85, t (9.5) | ||
4′-OCH3 | 61.5, CH3 | 3.74, s | 60.1, CH3 | 3.61, s | 61.4, CH3 | 3.80, s | ||
5′ | 79.5, CH | 4.06, m | 77.6, CH | 3.90, d (10.0) | 75.0, CH | 4.06, m | ||
6′ | 67.5, CH2 | 4.41, d (10.0) 4.08, m |
58.7, CH2 | 4.00, brd (2.0) | 60.4, CH2 | 4.12, d (11.5) 4.08, dd (11.5, 2.0) |
||
6′-OH | 6.34, t (4.0) | |||||||
1″ | 100.4, CH | 5.28, brs | ||||||
2″ | 38.7, CH2 | 2.54, m 2.03, m |
||||||
3″ | 65.4, CH | 4.02, m | ||||||
4″ | 61.5, CH | 3.05, m | ||||||
4″-NHCH3 | 31.6, CH3 | 2.51, s | ||||||
5″ | 59.0, CH2 | 4.04, m 3.84, m |
Assignments supported by 2D HSQC and HMBC experiments.
See Supporting Information for the NMR spectra.
CD3OD.
DMSO-d6.
Obtained from the HMBC spectrum.