Entry |
|
Name |
|
Formula |
C43H50CoN4O16
|
Exact mass |
937.2554
|
Mol weight |
937.8075
|
Structure |
|
Reaction |
|
Pathway |
|
Module |
M00924 | Cobalamin biosynthesis, anaerobic, uroporphyrinogen III => sirohydrochlorin => cobyrinate a,c-diamide |
|
Enzyme |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 64
1 C2y C 30.7300 -29.2320
2 C1y C 29.5490 -28.6025
3 C2x C 31.9516 -28.7765
4 N1y N 30.5166 -30.5428
5 C1z C 28.5810 -29.5423
6 C1b C 29.5659 -27.2692
7 C2y C 33.1382 -29.2772
8 C2y C 29.1945 -30.7516
9 C1b C 27.1534 -28.5619
10 C1a C 27.0919 -26.7225
11 C1b C 28.4119 -26.5936
12 C1z C 34.2855 -28.5970
13 N2x N 33.4192 -30.5824
14 C2y C 29.2003 -33.1978
15 C6a C 25.7176 -29.1077
16 C6a C 28.4287 -25.2650
17 C2y C 35.2872 -29.4859
18 C1b C 34.2799 -27.2468
19 C1a C 33.0303 -27.5428
20 C2y C 34.7469 -30.7064
21 O6a O 25.7200 -30.6094
22 O6a O 24.4233 -28.4931
23 O6a O 27.2872 -24.5898
24 O6a O 29.5940 -24.6082
25 C1b C 36.6206 -29.4804
26 C6a C 35.4396 -26.5767
27 C1x C 35.2479 -31.9439
28 C1y C 28.5810 -34.4031
29 N2x N 30.5111 -33.3957
30 C1b C 37.2793 -28.3150
31 O6a O 35.4396 -25.2490
32 O6a O 36.5980 -27.2411
33 C1z C 34.7130 -33.1757
34 C1z C 29.5434 -35.3257
35 C1b C 27.2702 -34.6162
36 C2y C 30.7244 -34.7178
37 C6a C 38.6183 -28.3037
38 C2y C 35.2929 -34.3975
39 N1y N 33.3910 -33.3619
40 C1b C 29.5321 -36.6648
41 C6a C 26.8033 -35.8593
42 C2x C 31.9516 -35.1734
43 O6a O 39.2761 -27.1452
44 O6a O 39.2929 -29.4634
45 C2y C 34.3194 -35.3033
46 C1b C 36.5810 -34.0432
47 C2y C 33.1495 -34.6726
48 C1b C 28.3623 -37.3336
49 O6a O 25.4926 -36.0850
50 O6a O 27.6469 -36.8893
51 C1b C 34.3195 -36.5422
52 C6a C 37.5265 -34.9704
53 C6a C 28.3567 -38.6783
54 C1b C 35.4105 -37.0859
55 O6a O 38.8147 -34.6220
56 O6a O 37.1948 -36.2712
57 O6a O 27.2026 -39.3370
58 O6a O 29.5038 -39.3483
59 C6a C 35.4119 -38.1808
60 O6a O 34.3895 -39.2046
61 O6a O 36.7064 -38.5891
62 Z Co 31.8725 -32.0349
63 C1a C 30.7693 -36.7657
64 C1a C 36.0097 -32.8188
BOND 69
1 2 6 1 #Down
2 3 7 1
3 4 8 1
4 5 9 1 #Up
5 5 10 1 #Down
6 6 11 1
7 7 12 1
8 7 13 2
9 8 14 2
10 9 15 1
11 11 16 1
12 12 17 1
13 12 18 1 #Up
14 12 19 1 #Down
15 13 20 1
16 15 21 1
17 15 22 2
18 16 23 1
19 16 24 2
20 17 25 1
21 18 26 1
22 20 27 1
23 14 28 1
24 14 29 1
25 25 30 1
26 26 31 1
27 26 32 2
28 27 33 1
29 28 34 1
30 28 35 1 #Up
31 29 36 2
32 30 37 1
33 33 38 1
34 33 39 1
35 34 40 1 #Down
36 35 41 1
37 36 42 1
38 37 43 1
39 37 44 2
40 38 45 2
41 38 46 1
42 39 47 1
43 40 48 1
44 41 49 1
45 41 50 2
46 45 51 1
47 46 52 1
48 48 53 1
49 51 54 1
50 52 55 1
51 52 56 2
52 53 57 1
53 53 58 2
54 54 59 1
55 59 60 1
56 59 61 2
57 5 8 1
58 17 20 2
59 34 36 1
60 42 47 2
61 45 47 1
62 1 2 1
63 1 3 2
64 34 63 1 #Up
65 1 4 1
66 2 5 1
67 33 64 1 #Down
68 4 62 1
69 62 39 1
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