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. Author manuscript; available in PMC: 2009 Aug 4.
Published in final edited form as: J Antibiot (Tokyo). 2008 Jul;61(7):457–463. doi: 10.1038/ja.2008.62

Table 3.

1H and 13C NMR data of 1 and 2 (500 and 125 MHz, δ in ppm, J in Hz)

1 (CD3OD) 2 (DMSO-dδ)

No. δCa δH HMBC δCa δH HMBC
1 63.8 62.1
1a 20.3 1.86 (3H, s) C-1, 1b, 2 19.1 1.81 (3H, s) 1, 1b, 2
1b 66.5 4.79 (1H, d, 11.6) C-1, 2 64.9 4.66 (1H, d, 11.6) 1, 2
4.45 (1H, d, 11.6) C-1, 1′, 2 4.40 (1H, d, 11.6)
2 173.0 171.3
4 95.1 93.8
4a 26.2 1.77 (3H, s) C-4, 5 25.4 1.71 (3H, s) 4, 5
5 42.1 3.62 (1H, d, 14.8) C-4, 6, 7, 27 39.8 3.74 (1H, d, 14.8) 4, 6, 7, 27
3.52 (1H, d, 14.8) 3.66 (1H, d, 14.8) 4, 6
6 136.8 135.4
7 119.3 7.38 (1H, br s) C-25, 27 118.0 7.51 (1H, br s) 5, 25, 27
8 138.4 136.7
9 133.8 8.07 (1H, d, 8.5) C-7, 25 132.5 8.19 (1H, AB) 11, 12, 24
10 125.3 8.21 (1H, d, 8.5) C-8, 12, 24 124.3 8.21 (1H, AB)
11 131.8 130.3
12 179.1 177.6
13 156.4 155.1
15 157.8 154.6
16 121.8 7.67 (1H, d, 9.0) C-15, 18, 20 120.9 7.81 (1H, d, 9.0) 15, 18, 20
17 125.9 7.36 (1H, dd, 9.0, 3.0) C-18 125.3 7.58 (1H, dd, 9.0, 3.0) 18
18 150.3 149.5
18-OH exchanged exchanged
19 109.7 7.53 (1H, d, 3.0) C-17, 18 109.5 7.65 (1H, d, 3.0) 18, 21
20 127.8 126.0
21 175.7 173.1
22 120.4 119.3
23 183.2 180.5
24 142.2 140.2
25 120.7 118.6
26 162.9 161.1
26-OH exchanged 13.41 (1H, s) 25, 26, 27
27 108.6 106.9
28 167.7 166.1
1′ 177.5 175.4
2′ 38.8 2.56 (1H, m) 36.7 2.51 (under DMSO) 1′, 2a', 3′
2a' 17.7 1.12 (3H, d, 7.0) C-3′ 16.9 1.05 (3H, d, 6.8) 1′, 2′, 3′
3′ 44.5 1.53-1.61 (2H, m) 42.7 1.46 (1H, m) 1′, 2′, 2a', 4′, 4a'
1.21-1.30 (1H, m) 1.18-1.25 (1H, m) 2′, 2a', 4a'
4′ 27.1 1.53-1.61 (2H, m) 25.3 1.52 (1H, m) 4a'
4a' 23.0 0.87 (3H, d, 6.3) C-3′, 4′, 5′ 22.3 0.81 (3H, d, 6.3) 3′, 4′, 4a', 5′
5′ 22.7 0.91 (3H, d, 6.3) C-3′, 4′, 4a' 22.2 0.85 (3H, d, 6.3) 3′, 4′, 4a', 5′
1″ 96.8 5.49 (1H, dd, 9.8, 2.0)
2″ 34.5 2.02-2.07 (1H, m)
1.81 (1H, m)
3″ 65.6 3.96 (1H, m) 4″, 5″
4″ 71.3 4.94 (1H, d, 2.9) 3″, 1-Ac
5″ 69.1 3.99 (1H, m) 6″
6″ 16.5 1.07 (3H, d, 6.4) 4″, 5″
1-Ac 170.3
2-Ac 20.8 2.11 (3H, s) 1-Ac
a

Assignments confirmed by HSQC correlations