 | | COMPOUND: C21511 | |
| Entry |
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| Name |
Nickel-sirohydrochlorin a,c-diamide;
Ni-sirohydrochlorin a,c-diamide
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| Formula |
C42H46N6NiO14
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| Exact mass |
916.2425
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| Mol weight |
917.5398
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| Structure |
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| Reaction |
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
| map01120 | Microbial metabolism in diverse environments |
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| Module |
| M00836 | Coenzyme F430 biosynthesis, sirohydrochlorin => coenzyme F430 |
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| Enzyme |
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| Other DBs |
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| KCF data |
ATOM 63
1 Z Ni 18.7598 -16.2398
2 C8y C 17.5556 -13.4480
3 C1y C 16.3494 -12.8052
4 C8x C 18.8032 -12.9827
5 N5x N 17.3377 -14.7866
6 C1z C 15.3609 -13.7649
7 C1b C 16.3668 -11.4435
8 C8y C 20.0150 -13.4941
9 C8y C 15.9876 -14.9998
10 C1b C 13.6039 -14.2394
11 C1a C 14.8497 -12.4999
12 C1b C 15.1883 -10.7535
13 C1z C 21.1866 -12.7995
14 N4y N 20.3020 -14.8271
15 C8x C 15.3322 -16.2520
16 C5a C 12.7641 -13.2652
17 C6a C 15.2055 -9.3967
18 C1y C 22.2097 -13.7073
19 C1b C 21.1809 -11.4206
20 C1a C 19.8769 -12.0153
21 C8y C 21.6579 -14.9537
22 C8y C 15.9876 -17.4984
23 N1a N 11.0195 -13.2676
24 O5a O 12.8344 -11.9416
25 O6a O 13.9492 -8.5333
26 O6a O 16.3955 -8.7259
27 C1b C 23.5714 -13.7016
28 C5a C 22.3652 -10.7363
29 C8x C 22.1694 -16.2174
30 C8y C 15.3609 -18.7288
31 N4y N 17.3320 -17.7001
32 C1b C 24.2442 -12.5115
33 N1a N 22.3652 -9.3803
34 O5a O 23.5483 -11.4147
35 C8y C 21.6233 -17.4754
36 C8y C 16.3437 -19.6710
37 C1b C 14.0224 -18.9465
38 C8y C 17.5499 -19.0502
39 C6a C 25.6115 -12.4999
40 C8y C 22.2155 -18.7231
41 N5x N 20.2731 -17.6655
42 C1b C 16.3322 -21.0386
43 C6a C 13.5456 -20.2160
44 C8x C 18.8032 -19.5155
45 O6a O 26.2832 -11.3168
46 O6a O 26.3004 -13.6842
47 C8y C 21.2212 -19.6481
48 C1b C 23.5309 -18.3613
49 C8y C 20.0265 -19.0041
50 C1b C 15.1377 -21.7217
51 O6a O 12.2070 -20.4465
52 O6a O 14.4071 -21.2679
53 C1b C 21.3537 -21.0040
54 C6a C 24.4966 -19.3082
55 C6a C 15.1320 -23.0949
56 C1b C 22.6001 -21.5731
57 O6a O 25.8121 -18.9523
58 O6a O 24.1578 -20.6366
59 O6a O 13.9534 -23.7676
60 O6a O 16.3033 -23.7792
61 C6a C 22.7269 -22.9348
62 O6a O 21.6061 -23.7158
63 O6a O 23.9792 -23.4911
BOND 68
1 2 3 1
2 2 4 1
3 2 5 2
4 3 6 1
5 3 7 1 #Down
6 4 8 2
7 5 9 1
8 6 10 1 #Up
9 6 11 1 #Down
10 7 12 1
11 8 13 1
12 8 14 1
13 9 15 2
14 10 16 1
15 12 17 1
16 13 18 1
17 13 19 1 #Up
18 13 20 1 #Down
19 14 21 1
20 15 22 1
21 16 23 1
22 16 24 2
23 17 25 1
24 17 26 2
25 18 27 1 #Down
26 19 28 1
27 21 29 2
28 22 30 2
29 22 31 1
30 27 32 1
31 28 33 1
32 28 34 2
33 29 35 1
34 30 36 1
35 30 37 1
36 31 38 1
37 32 39 1
38 35 40 1
39 35 41 2
40 36 42 1
41 37 43 1
42 38 44 1
43 39 45 1
44 39 46 2
45 40 47 2
46 40 48 1
47 41 49 1
48 42 50 1
49 43 51 1
50 43 52 2
51 47 53 1
52 48 54 1
53 50 55 1
54 53 56 1
55 54 57 1
56 54 58 2
57 55 59 1
58 55 60 2
59 56 61 1
60 61 62 1
61 61 63 2
62 6 9 1
63 18 21 1
64 36 38 2
65 44 49 2
66 47 49 1
67 1 14 1
68 1 31 1
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