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. Author manuscript; available in PMC: 2010 Aug 28.
Published in final edited form as: Chem Biol. 2009 Aug 28;16(8):893–906. doi: 10.1016/j.chembiol.2009.06.012

Table 1.

NMR data of hoiamide A (1) in DMSO-d6.

Unit Carbon δCa δH, multiplicity (Hz)b COSY HMBC (1H to 13C) NOESY
Thr 1 170.2
2 58.0 4.55, dd (7.7, 2.8) 2NH, 3 1, 3 4
NH 7.86, d (8.0) 2 2, 3, 5 4, 6, 7
3 66.0 4.28, m 2, 4
4 20.2 1.15, d (6.6) 3 2, 3 2, 2NH

Hiva 5 169.4
6 75.8 4.91, d (3.4) 7 5, 7, 8, 9, 10 2NH, 8
7 30.0 2.18, m 6, 8, 9 8 2NH
8 18.9 0.90, d (6.9) 7 6, 7, 9 6
9 16.0 0.76, d (6.9) 7 6, 7, 8

Ahdhe 10 174.2
11 44.3 2.30, dq (9.0, 7.2) 12, 18 10, 12, 18 13NH
12 71.1 3.78, d (9.6) 11 10, 11, 18 17, 18
13 52.6 3.53, dd (11.4, 10.2) 13NH, 14 14, 17, 19 15a, 17, 18
NH 6.82, d (9.8) 13 12, 13, 19 11, 14, 22
14 35.8 1.55, m 13, 15b, 17 13NH
15 25.1 a1.04, ddq (13.8, 7.8, 7.2) 15b, 16 13, 16, 17 13
b1.42, m 14, 15a, 16 14
16 11.1 0.838, t (6.3) 15a, 15b 15
17 15.6 0.85, d (6.0) 14 13, 14, 15 12, 13
18 13.8 0.95, d (6.8) 11 10, 11, 12 12, 13

MoCys1 19 173.1
20 84.6
21 41.0 a3.19, d (11.4) 21b 19, 20, 22, 23 22
b3.81, d (11.4) 21a 19, 20, 22, 23 22
22 25.4 1.54, s 19, 20, 21 21a, 21b, 13NH

MoCys2 23 175.8
24 83.3
25 42.6 a3.46, d (11.2) 25b 23, 24, 26, 27 26
b3.51, d (11.0) 25a 23, 24, 26
26 24.1 1.63, s 23, 24, 25 25a

MoCys3 27 162.1
28 147.4
29 122.4 8.01, s 27, 28, 30

Dmetua 30 168.3
31 33.1 a2.92, dd (15.8, 2.0) 31b, 32 30 34, 43
b2.99, dd (15.8, 9.2) 31a, 32 30, 32 43
32 79.5 3.80, m 31a, 31b, 33 30, 43, 44 43
33 35.7 2.34, m 32, 34, 43 32, 24 35, 44
34 75.2 5.18, d (9.8) 33, 35 1, 32, 33, 35, 36, 42 31a, 36, 43
35 38.5 1.70, dq (7.8, 7.2) 34, 36, 42 33, 36, 42 33, 41, 43
36 72.1 3.18, dd (10.2, 1.4) 35, 37 34, 38, 41 34, 38b, 42
37 33.6 1.48, m 36, 38a, 38b, 41 38, 39 42
38 36.6 a1.15, m 37, 39 36, 37, 39, 40, 41
b1.26, m 37 37, 39, 40, 41 36
39 19.9 1.25, m 38a, 40 38
40 14.3 0.835, t (6.8) 39 39
41 11.9 0.72, d (6.6) 37 36, 37, 38 35
42 10.0 0.82, d (6.8) 35 35, 36 36, 37
43 10.8 0.838, d (6.3) 33 32, 33, 34 31a, 31b, 32, 34, 35
44 56.7 3.23, s 32 33
a

Recorded at 125 MHz.

b

Recorded at 500 MHz.