 | | COMPOUND: C00748 | |
Entry |
|
Name |
|
Formula |
C42H44FeN4O16
|
Exact mass |
916.2102
|
Mol weight |
916.66
|
Structure |

|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00846 | Siroheme biosynthesis, glutamyl-tRNA => siroheme |
M00847 | Heme biosynthesis, archaea, siroheme => heme |
|
Enzyme |
|
Other DBs |
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KCF data |
ATOM 63
1 C8y C 26.1460 -15.8483
2 C1y C 24.9354 -15.2027
3 C8x C 27.4057 -15.3830
4 N5x N 25.9320 -17.1935
5 C1z C 23.9459 -16.1700
6 C1b C 24.9530 -13.8340
7 C8y C 28.6223 -15.8950
8 C8y C 24.5750 -17.4100
9 C1b C 22.1757 -16.6448
10 C1a C 23.4266 -14.8927
11 C1b C 23.7705 -13.1405
12 C1z C 29.7978 -15.1969
13 N4y N 28.9136 -17.2345
14 C8x C 23.9167 -18.6675
15 C6a C 21.3302 -15.6627
16 C6a C 23.7880 -11.7769
17 C1y C 30.8296 -16.1115
18 C1b C 29.7921 -13.8108
19 C1a C 28.4820 -14.4077
20 C8y C 30.2763 -17.3630
21 C8y C 24.5750 -19.9189
22 O6a O 22.5264 -10.9073
23 O6a O 24.9822 -11.1029
24 C1b C 32.1981 -16.1058
25 C6a C 30.9874 -13.1231
26 C8x C 30.7886 -18.6324
27 C8y C 23.9459 -21.1541
28 N4y N 25.9262 -20.1235
29 C1b C 32.8741 -14.9043
30 O6a O 30.9874 -11.7603
31 O6a O 32.1747 -13.8049
32 C8y C 30.2412 -19.8954
33 C8y C 24.9296 -22.1038
34 C1b C 22.6007 -21.3751
35 C8y C 26.1403 -21.4805
36 C6a C 34.2485 -14.8927
37 C8y C 30.8354 -21.1484
38 N5x N 28.8843 -20.0885
39 C1b C 24.9179 -23.4782
40 C6a C 22.1165 -22.6502
41 C8x C 27.4057 -21.9457
42 O6a O 34.9236 -13.7054
43 O6a O 34.9410 -16.0881
44 C8y C 29.8329 -22.0805
45 C1b C 32.1571 -20.7880
46 C8y C 28.6339 -21.4336
47 C1b C 23.7191 -24.1648
48 O6a O 20.7713 -22.8842
49 O6a O 22.9842 -23.7112
50 C1b C 29.9674 -23.4432
51 C6a C 33.1304 -21.7425
52 C6a C 23.7134 -25.5452
53 C1b C 31.2188 -24.0140
54 O6a O 34.4522 -21.3810
55 O6a O 32.7864 -23.0772
56 O6a O 22.5307 -26.2212
57 O6a O 24.8885 -26.2328
58 C6a C 31.3477 -25.3827
59 O6a O 30.2237 -26.1686
60 O6a O 32.6051 -25.9476
61 Z Fe 27.3236 -18.7267
62 O6a O 21.7604 -14.4438
63 O6a O 20.0612 -15.9067
BOND 68
1 1 3 1
2 1 4 2
3 2 5 1
4 2 6 1 #Down
5 3 7 2
6 4 8 1
7 5 9 1 #Up
8 5 10 1 #Down
9 6 11 1
10 7 12 1
11 7 13 1
12 8 14 2
13 9 15 1
14 11 16 1
15 12 17 1
16 12 18 1 #Up
17 12 19 1 #Down
18 13 20 1
19 14 21 1
20 16 22 1
21 16 23 2
22 17 24 1 #Down
23 18 25 1
24 20 26 2
25 21 27 2
26 21 28 1
27 24 29 1
28 25 30 1
29 25 31 2
30 26 32 1
31 27 33 1
32 27 34 1
33 28 35 1
34 29 36 1
35 32 37 1
36 32 38 2
37 33 39 1
38 34 40 1
39 35 41 1
40 36 42 1
41 36 43 2
42 37 44 2
43 37 45 1
44 38 46 1
45 39 47 1
46 40 48 1
47 40 49 2
48 44 50 1
49 45 51 1
50 47 52 1
51 50 53 1
52 51 54 1
53 51 55 2
54 52 56 1
55 52 57 2
56 53 58 1
57 58 59 1
58 58 60 2
59 5 8 1
60 17 20 1
61 33 35 2
62 41 46 2
63 44 46 1
64 13 61 1
65 28 61 1
66 15 62 2
67 1 2 1
68 15 63 1
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