| Entry |
|
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| Name |
Methylmalonyl-CoA;
Methylmalonyl coenzyme A;
2-Methylmalonyl-CoA
|
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| Formula |
C25H40N7O19P3S
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| Exact mass |
867.1313
|
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| Mol weight |
867.61
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| Structure |
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| Reaction |
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| Pathway |
| map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00773 | Tylosin biosynthesis, methylmalonyl-CoA + malonyl-CoA => tylactone => tylosin |
| M00775 | Oleandomycin biosynthesis, malonyl-CoA + methylmalonyl-CoA => 8,8a-deoxyoleandolide => oleandomycin |
| M00934 | Mycinamicin biosynthesis, malonyl-CoA + methylmalonyl-CoA => protomycinolide IV => mycinamicin II |
|
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| Enzyme |
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 55
1 C1c C 29.6324 -38.5000
2 C5a C 30.8449 -37.8000
3 S2a S 32.0573 -38.5000
4 C1b C 33.2697 -37.8000
5 C1b C 34.4822 -38.5000
6 N1b N 35.6946 -37.8000
7 C5a C 36.9070 -38.5000
8 C1b C 38.1195 -37.8000
9 C1b C 39.3319 -38.5000
10 N1b N 40.5444 -37.8000
11 C5a C 41.7568 -38.5000
12 C1c C 42.9692 -37.8000
13 C1d C 44.1817 -38.5000
14 C1b C 45.3941 -37.8000
15 O2b O 46.6065 -38.5000
16 O5a O 30.8449 -36.4002
17 O5a O 36.9070 -39.8999
18 O5a O 41.7568 -39.8996
19 O1a O 42.9692 -36.4000
20 C1a C 44.1817 -37.1000
21 C1a C 44.1817 -39.9000
22 P1b P 48.0065 -38.5000
23 O1c O 49.4065 -38.5000
24 O1c O 48.0065 -39.9000
25 C1y C 41.5100 -33.5300
26 C1y C 42.9100 -33.5300
27 C1y C 43.3426 -32.1985
28 O2x O 42.2100 -31.3756
29 C1y C 41.0774 -32.1985
30 C1b C 44.6622 -31.7697
31 O1a O 40.6871 -34.6626
32 O2b O 43.7329 -34.6626
33 P1b P 45.1329 -34.6626
34 O1c O 45.1329 -33.2626
35 O1c O 46.5329 -34.6626
36 O1c O 45.1329 -36.0626
37 C8y C 36.9600 -30.3800
38 C8y C 36.9600 -31.7800
39 N4y N 39.3849 -31.7800
40 C8x C 39.3849 -30.3800
41 N5x N 38.1724 -29.6800
42 C8y C 35.7476 -29.6800
43 N5x N 34.5351 -30.3800
44 C8x C 34.5351 -31.7800
45 N5x N 35.7476 -32.4800
46 N1a N 35.7476 -28.2802
47 O2b O 46.6445 -32.2020
48 P1b P 48.0445 -32.2020
49 O1c O 48.0445 -30.8020
50 O1c O 49.4445 -32.2020
51 O2c O 48.0445 -35.4220
52 C6a C 28.4033 -37.7902
53 O6a O 27.1992 -38.4853
54 O6a O 28.4035 -36.4001
55 C1a C 29.6323 -39.8998
BOND 57
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 13 14 1
14 14 15 1
15 2 16 2
16 7 17 2
17 11 18 2
18 12 19 1 #Down
19 13 20 1
20 13 21 1
21 15 22 1
22 22 23 2
23 22 24 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 29 1
28 25 29 1
29 27 30 1 #Down
30 25 31 1 #Up
31 26 32 1 #Up
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 2
36 37 38 2
37 38 39 1
38 39 40 1
39 40 41 2
40 37 41 1
41 37 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 38 45 1
46 42 46 1
47 29 39 1 #Down
48 30 47 1
49 47 48 1
50 48 49 1
51 48 50 2
52 48 51 1
53 22 51 1
54 1 52 1
55 52 53 1
56 52 54 2
57 1 55 1
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