Entry |
|
Name |
Rifalazil (USAN/INN); RLZ |
Formula |
C51H64N4O13
|
Exact mass |
940.447
|
Mol weight |
941.0729
|
Structure |
|
Simcomp |
|
Class |
|
Efficacy |
Antibacterial (antimycobacterial) |
Comment |
Rifamycin derivative
|
Target |
DNA-directed RNA polymerase subunit beta [KO: K03043] |
Interaction |
|
Structure map |
|
Brite |
Drug groups [BR:br08330]
Antibacterial
DG01966 Antitubercular
DG01598 Rifamycin antibiotic
D02550 Rifalazil
Antimicrobials [BR:br08307]
Antibacterials
Nucleic acid synthesis inhibitor
Rifamycin
D02550 Rifalazil (USAN/INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 68
1 C1c C 29.5400 -4.7600
2 C1c C 29.5400 -6.2300
3 O1a O 31.9900 -6.1600
4 C1c C 31.9900 -4.7600
5 C1c C 30.7300 -4.0600
6 C2b C 34.3700 -4.7600
7 C1c C 33.1800 -4.0600
8 C5a C 35.6300 -6.9300
9 C2c C 36.8200 -6.2300
10 C2b C 36.8200 -4.7600
11 C2b C 35.6300 -4.0600
12 C1a C 33.1800 -2.6600
13 C1a C 30.7300 -2.6600
14 O1a O 28.3500 -4.0600
15 C1a C 38.0100 -6.9300
16 O5a O 34.4400 -6.2300
17 N1b N 35.6300 -8.6100
18 C1c C 28.3500 -6.9300
19 O7a O 27.1600 -6.2300
20 C1c C 28.3500 -8.6100
21 C8y C 34.4400 -9.3100
22 C8y C 34.4400 -10.7100
23 C8y C 33.1800 -8.6100
24 C8y C 31.9900 -9.3100
25 C8y C 31.9900 -10.7100
26 C8y C 33.1800 -11.4100
27 C8y C 30.8000 -8.6100
28 C8y C 29.5400 -9.3100
29 C8y C 29.5400 -10.7100
30 C8y C 30.8000 -11.4100
31 O5x O 33.1800 -7.2100
32 O1a O 30.8000 -7.2100
33 C1a C 28.3500 -5.1100
34 C7a C 25.9000 -5.5300
35 C1a C 24.7100 -6.2300
36 O6a O 25.9000 -4.1300
37 C1c C 27.1600 -9.3100
38 O2a O 25.9700 -8.6100
39 C2b C 27.1600 -10.7100
40 C1a C 27.1600 -7.6300
41 C1a C 24.7800 -9.3100
42 C2b C 25.9700 -11.4100
43 O2a O 25.9700 -12.8100
44 O2x O 28.3500 -11.4100
45 C1z C 28.3500 -12.8100
46 C5x C 30.8000 -12.8100
47 C1a C 28.3500 -14.2100
48 C1a C 29.5400 -7.9100
49 N5x N 33.1569 -12.8098
50 C8y C 34.3576 -13.5297
51 C8y C 35.6176 -12.8297
52 O2x O 35.6407 -11.4299
53 C8y C 34.4045 -14.9295
54 C8x C 35.5352 -15.6494
55 C8y C 36.7952 -14.9494
56 C8x C 36.8183 -13.5496
57 O1a O 33.1716 -15.6338
58 N1y N 38.0278 -15.6880
59 C1x C 38.0051 -17.0800
60 C1x C 39.2059 -17.7997
61 N1y N 40.4296 -17.1196
62 C1x C 40.4523 -15.7276
63 C1x C 39.2515 -15.0079
64 C1b C 41.6664 -17.8604
65 C1c C 42.8817 -17.1844
66 C1a C 44.0877 -17.9070
67 C1a C 42.9040 -15.7500
68 O5x O 31.9508 -13.4801
BOND 74
1 1 2 1
2 4 3 1 #Down
3 4 5 1
4 1 5 1
5 6 7 1
6 4 7 1
7 8 9 1
8 9 10 2
9 10 11 1
10 6 11 2
11 7 12 1 #Up
12 5 13 1 #Down
13 1 14 1 #Down
14 9 15 1
15 8 16 2
16 8 17 1
17 2 18 1
18 18 19 1 #Up
19 18 20 1
20 17 21 1
21 21 22 2
22 21 23 1
23 23 24 1
24 24 25 1
25 25 26 1
26 24 27 2
27 27 28 1
28 28 29 2
29 29 30 1
30 25 30 2
31 23 31 2
32 27 32 1
33 2 33 1 #Up
34 19 34 1
35 34 35 1
36 34 36 2
37 26 22 1
38 20 37 1
39 37 38 1 #Down
40 37 39 1
41 20 40 1 #Down
42 38 41 1
43 39 42 2
44 42 43 1
45 29 44 1
46 44 45 1
47 43 45 1
48 30 46 1
49 45 46 1
50 45 47 1 #Down
51 28 48 1
52 26 49 2
53 49 50 1
54 50 51 1
55 51 52 1
56 22 52 1
57 50 53 2
58 53 54 1
59 54 55 2
60 55 56 1
61 51 56 2
62 53 57 1
63 55 58 1
64 58 59 1
65 59 60 1
66 60 61 1
67 61 62 1
68 62 63 1
69 58 63 1
70 61 64 1
71 64 65 1
72 65 66 1
73 65 67 1
74 68 46 2
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