| | COMPOUND: C14119 | |
Entry |
|
Name |
Naphthyl-2-oxomethyl-succinyl-CoA
|
Formula |
C36H46N7O20P3S
|
Exact mass |
1021.1731
|
Mol weight |
1021.77
|
Structure |
|
Reaction |
|
Pathway |
map01120 | Microbial metabolism in diverse environments |
map01220 | Degradation of aromatic compounds |
|
Enzyme |
1.1.-.- 2.3.1.-
|
Other DBs |
|
KCF data |
ATOM 67
1 S2a S 31.4973 -24.5700
2 C1b C 32.7097 -23.8700
3 C1b C 33.9222 -24.5700
4 N1b N 35.1346 -23.8700
5 C5a C 36.3470 -24.5700
6 C1b C 37.5595 -23.8700
7 C1b C 38.7719 -24.5700
8 N1b N 39.9844 -23.8700
9 C5a C 41.1968 -24.5700
10 C1c C 42.4092 -23.8700
11 C1d C 43.6217 -24.5700
12 C1b C 44.8341 -23.8700
13 O2b O 46.0465 -24.5700
14 O5a O 36.3470 -25.9699
15 O5a O 41.1968 -25.9696
16 O1a O 42.4092 -22.4700
17 C1a C 43.6217 -23.1700
18 C1a C 43.6217 -25.9700
19 P1b P 47.4465 -24.5700
20 O1c O 48.8465 -24.5700
21 O1c O 47.4465 -25.9700
22 C1y C 40.9500 -19.6000
23 C1y C 42.3500 -19.6000
24 C1y C 42.7826 -18.2685
25 O2x O 41.6500 -17.4456
26 C1y C 40.5174 -18.2685
27 C1b C 44.1022 -17.8397
28 O1a O 40.1271 -20.7326
29 O2b O 43.1729 -20.7326
30 P1b P 44.5729 -20.7326
31 O1c O 44.5729 -19.3326
32 O1c O 45.9729 -20.7326
33 O1c O 44.5729 -22.1326
34 C8y C 36.4000 -16.4500
35 C8y C 36.4000 -17.8500
36 N4y N 38.8249 -17.8500
37 C8x C 38.8249 -16.4500
38 N5x N 37.6124 -15.7500
39 C8y C 35.1876 -15.7500
40 N5x N 33.9751 -16.4500
41 C8x C 33.9751 -17.8500
42 N5x N 35.1876 -18.5500
43 N1a N 35.1876 -14.3502
44 O2b O 46.0845 -18.2720
45 P1b P 47.4845 -18.2720
46 O1c O 47.4845 -16.8720
47 O1c O 48.8845 -18.2720
48 O2c O 47.4845 -21.4920
49 C5a C 30.2869 -23.8712
50 C1c C 29.0924 -24.5610
51 O5a O 30.2868 -22.4702
52 C5a C 27.9046 -23.8752
53 C8y C 26.7136 -24.5631
54 C1b C 29.0923 -25.9697
55 O5a O 27.9044 -22.4702
56 C8x C 25.5239 -23.8764
57 C8y C 24.3115 -24.5765
58 C8y C 24.3116 -25.9765
59 C8x C 25.5013 -26.6632
60 C8x C 26.7137 -25.9631
61 C8x C 23.0990 -23.8765
62 C8x C 21.8867 -24.5766
63 C8x C 21.8868 -25.9766
64 C8x C 23.0993 -26.6765
65 C6a C 30.3255 -26.6819
66 O6a O 31.5314 -25.9858
67 O6a O 30.3252 -28.0699
BOND 71
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 5 14 2
14 9 15 2
15 10 16 1 #Down
16 11 17 1
17 11 18 1
18 13 19 1
19 19 20 2
20 19 21 1
21 22 23 1
22 23 24 1
23 24 25 1
24 25 26 1
25 22 26 1
26 24 27 1 #Down
27 22 28 1 #Up
28 23 29 1 #Up
29 29 30 1
30 30 31 1
31 30 32 1
32 30 33 2
33 34 35 2
34 35 36 1
35 36 37 1
36 37 38 2
37 34 38 1
38 34 39 1
39 39 40 2
40 40 41 1
41 41 42 2
42 35 42 1
43 39 43 1
44 26 36 1 #Down
45 27 44 1
46 44 45 1
47 45 46 1
48 45 47 2
49 45 48 1
50 19 48 1
51 1 49 1
52 49 50 1
53 49 51 2
54 50 52 1
55 52 53 1
56 50 54 1
57 52 55 2
58 53 56 2
59 56 57 1
60 57 58 2
61 58 59 1
62 59 60 2
63 53 60 1
64 57 61 1
65 61 62 2
66 62 63 1
67 63 64 2
68 58 64 1
69 54 65 1
70 65 66 1
71 65 67 2
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