Entry |
|
Name |
2-Hydroxy-5-methyl-cis,cis-muconate
|
Formula |
C7H8O5
|
Exact mass |
172.0372
|
Mol weight |
172.1354
|
Structure |
|
Reaction |
|
Pathway |
map01120 | Microbial metabolism in diverse environments |
map01220 | Degradation of aromatic compounds |
|
Module |
M00569 | Catechol meta-cleavage, catechol => acetyl-CoA / 4-methylcatechol => propanoyl-CoA |
|
Enzyme |
|
Other DBs |
|
KCF data |
ATOM 12
1 C2c C 25.2345 -19.1969
2 C6a C 24.0264 -19.9030
3 C2b C 26.4542 -19.8797
4 C1a C 25.2228 -17.7963
5 O6a O 24.0381 -21.2978
6 O6a O 22.8067 -19.2144
7 C2b C 26.4717 -21.2803
8 C2c C 27.6914 -21.9690
9 C6a C 28.8936 -21.2570
10 O1a O 27.7031 -23.3754
11 O6a O 30.1133 -21.9456
12 O6a O 28.8819 -19.8563
BOND 11
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 7 8 2
8 8 9 1
9 8 10 1
10 9 11 1
11 9 12 2
|