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. Author manuscript; available in PMC: 2010 Jun 1.
Published in final edited form as: J Nat Prod. 2009 Jun;72(6):1011–1016. doi: 10.1021/np9001674

Table 1.

1H and 13C NMR Data for DMMC (1) Recorded in CDCl3 at 400 and 100 MHz, Respectively.

Residue Position δC δH, mult., J (Hz) HMBCa
Map 1 172.8
2 42.7 2.76, qd (7.0, 1.6) 1, 3
3 51.4 4.52, m
4 (NH) 7.07, d (10.1) 3, 8
5 10.0 1.10, d (7.0) 1, 2, 3
6 26.3 1.56, m;1.48, m 2, 3, 7
7 11.2 0.93, t (7.4) 3, 6
Ala 8 173.0
9 48.5 4.45, m 8, 11
10 (NH) 7.76, d (7.9) 9, 11, 12
11 15.7 1.07, d (7.9) 8, 9
Ibu 12 172.3
13 55.1
14 210.3
15 52.0 4.92, m 14, 19
16 (NH) 7.32, d (6.4) 14, 15, 20
17 22.5 1.53, s 12, 13, 14, 18
18 21.7 1.48, s 12, 13, 14, 17
19 19.3 1.16, d (6.8) 14, 15
N-Me Phe 20 168.0
21 61.0 5.23, m 20, 23, 24, 30
22 (N)
23 35.7 3.31, dd (14.0, 6.3) 20, 21, 24, 25/29
2.89, dd (14.0, 8.2)
24 137.0
25/29 129.7 7.25, m 23, 24, 26/28, 27
26/28 129.0 7.28, m 24, 25/29
27 127.2 7.20, t (6.9) 25/29
30 29.5 2.99, s 21, 31
N-MeVal 31 170.4
32 58.3 4.79, d (10.6) 31, 34, 35, 36, 37, 38
33 (N)
34 27.3 2.22, m 32, 35, 36
35 18.7 0.33, d (6.4) 32, 34, 36
36 18.6 0.74, d (6.5) 32, 34, 35
37 29.5 2.97, s 32, 38
Gly 38 169.5
39 40.8 4.62, dd (17.6, 7.9) 38, 41
3.47, d (17.6)
40 (NH) 7.58 d (7.9) 41
N-MeIle 41 171.3
42 61.4 4.91, m 41, 44, 45, 47, 48, 49
43 (N)
44 33.0 2.11, m
45 25.2 1.46, m;1.11, m 44
46 10.3 0.89, m 44, 45
47 15.8 1.03, d (7.3) 42, 44, 45
48 30.6 3.22, s 42, 49
Gly 49 170.2
50 41.0 4.44, m 49, 52
3.57, dd (15.9, 4.6)
51 (NH) 7.36, t (5.5) 49, 50
Hmpa 52 170.7
53 78.6 5.21, m 1, 52, 54, 55, 57
54 37.6 2.07, m
55 24.0 1.47, m;1.24, m 53, 54, 56
56 11.9 0.90, m 54, 55
57 15.4 0.90, m 53, 54
a

Proton showing correlation to indicated carbon resonance.