| Entry |
|
|---|
| Name |
2-Methylpropanoyl-CoA;
2-Methylpropionyl-CoA;
Isobutyryl-CoA
|
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| Formula |
C25H42N7O17P3S
|
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| Exact mass |
837.1571
|
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| Mol weight |
837.63
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| Structure |
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| Reaction |
|
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| Pathway |
| map00280 | Valine, leucine and isoleucine degradation |
| map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
| map00907 | Pinene, camphor and geraniol degradation |
| map00996 | Biosynthesis of various alkaloids |
| map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
| map01110 | Biosynthesis of secondary metabolites |
| map01210 | 2-Oxocarboxylic acid metabolism |
|
|---|
| Module |
| M00777 | Avermectin biosynthesis, 2-methylbutanoyl-CoA/isobutyryl-CoA => 6,8a-Seco-6,8a-deoxy-5-oxoavermectin 1a/1b aglycone => avermectin A1a/B1a/A1b/B1b |
|
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| Network |
nt06024 Valine, leucine and isoleucine degradation nt06032 Lipoic acid metabolism |
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA07 Fatty esters
FA0705 Fatty acyl CoAs
C00630 2-Methylpropanoyl-CoA
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 53
1 C1c C 29.0724 -34.0200
2 C5a C 30.2849 -33.3200
3 S2a S 31.4973 -34.0200
4 C1b C 32.7097 -33.3200
5 C1b C 33.9222 -34.0200
6 N1b N 35.1346 -33.3200
7 C5a C 36.3470 -34.0200
8 C1b C 37.5595 -33.3200
9 C1b C 38.7719 -34.0200
10 N1b N 39.9844 -33.3200
11 C5a C 41.1968 -34.0200
12 C1c C 42.4092 -33.3200
13 C1d C 43.6217 -34.0200
14 C1b C 44.8341 -33.3200
15 O2b O 46.0465 -34.0200
16 O5a O 30.2849 -31.9202
17 O5a O 36.3470 -35.4199
18 O5a O 41.1968 -35.4196
19 O1a O 42.4092 -31.9200
20 C1a C 43.6217 -32.6200
21 C1a C 43.6217 -35.4200
22 P1b P 47.4465 -34.0200
23 O1c O 48.8465 -34.0200
24 O1c O 47.4465 -35.4200
25 C1y C 40.9500 -29.0500
26 C1y C 42.3500 -29.0500
27 C1y C 42.7826 -27.7185
28 O2x O 41.6500 -26.8956
29 C1y C 40.5174 -27.7185
30 C1b C 44.1022 -27.2897
31 O1a O 40.1271 -30.1826
32 O2b O 43.1729 -30.1826
33 P1b P 44.5729 -30.1826
34 O1c O 44.5729 -28.7826
35 O1c O 45.9729 -30.1826
36 O1c O 44.5729 -31.5826
37 C8y C 36.4000 -25.9000
38 C8y C 36.4000 -27.3000
39 N4y N 38.8249 -27.3000
40 C8x C 38.8249 -25.9000
41 N5x N 37.6124 -25.2000
42 C8y C 35.1876 -25.2000
43 N5x N 33.9751 -25.9000
44 C8x C 33.9751 -27.3000
45 N5x N 35.1876 -28.0000
46 N1a N 35.1876 -23.8002
47 O2b O 46.0845 -27.7220
48 P1b P 47.4845 -27.7220
49 O1c O 47.4845 -26.3220
50 O1c O 48.8845 -27.7220
51 O2c O 47.4845 -30.9420
52 C1a C 27.8433 -33.3102
53 C1a C 29.0723 -35.4198
BOND 55
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 1 53 1
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