| Entry |
|
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| Name |
Coenzyme M 7-mercaptoheptanoylthreonine-phosphate heterodisulfide;
Coenzyme M-HTP heterodisulfide;
CoM-S-S-CoB;
N-{7-[(2-Sulfoethyl)dithio]heptanoyl}-3-O-phospho-L-threonine
|
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| Formula |
C13H26NO10PS3
|
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| Exact mass |
483.0456
|
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| Mol weight |
483.52
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| Structure |
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| Reaction |
|
|---|
| Pathway |
| map01120 | Microbial metabolism in diverse environments |
|
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| Module |
| M00356 | Methanogenesis, methanol => methane |
| M00357 | Methanogenesis, acetate => methane |
| M00563 | Methanogenesis, methylamine/dimethylamine/trimethylamine => methane |
| M00567 | Methanogenesis, CO2 => methane |
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| Enzyme |
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 28
1 C1b C 32.4222 -24.5035
2 S4a S 33.7909 -24.5092
3 C1b C 31.2971 -23.6501
4 O1d O 33.7781 -25.9072
5 O1d O 35.1701 -24.4976
6 O1d O 33.8364 -23.0404
7 S3a S 30.0649 -24.3192
8 S3a S 28.8746 -23.5906
9 C1c C 20.3079 -20.1812
10 C1c C 19.0872 -19.4583
11 N1b N 20.3545 -21.5499
12 C6a C 21.5926 -19.6425
13 O2b O 19.1244 -18.0547
14 C1a C 17.7967 -20.0215
15 C5a C 20.3732 -22.9534
16 O6a O 22.7900 -20.3770
17 O6a O 21.5878 -18.3030
18 P1b P 19.1244 -16.6510
19 C1b C 21.5869 -23.6401
20 O5a O 19.1584 -23.6575
21 O1c O 19.1244 -15.2531
22 O1c O 20.5223 -16.6453
23 O1c O 17.7138 -16.6569
24 C1b C 22.7957 -22.9290
25 C1b C 24.0153 -23.6225
26 C1b C 25.2242 -22.9115
27 C1b C 26.4378 -23.6109
28 C1b C 27.6526 -22.8998
BOND 27
1 2 5 2
2 2 6 2
3 3 7 1
4 7 8 1
5 1 2 1
6 1 3 1
7 2 4 1
8 9 10 1
9 9 11 1 #Up
10 9 12 1
11 10 13 1 #Up
12 10 14 1
13 11 15 1
14 12 16 1
15 12 17 2
16 13 18 1
17 15 19 1
18 15 20 2
19 18 21 1
20 18 22 1
21 18 23 2
22 19 24 1
23 24 25 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 8 1
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