| Entry |
|
|---|
| Name |
2-Hydroxyhepta-2,4-dienedioate;
2-Hydroxyhepta-2,4-diene-1,7-dioate
|
|---|
| Formula |
C7H8O5
|
|---|
| Exact mass |
172.0372
|
|---|
| Mol weight |
172.14
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01120 | Microbial metabolism in diverse environments |
| map01220 | Degradation of aromatic compounds |
|
|---|
| Module |
| M00533 | Homoprotocatechuate degradation, homoprotocatechuate => 2-oxohept-3-enedioate |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 12
1 C2b C 25.7215 -23.5438
2 C2b C 24.4996 -22.8422
3 C2c C 26.9374 -22.8365
4 C2b C 23.2894 -23.5497
5 C6a C 28.1534 -23.5321
6 O1a O 26.9374 -21.4391
7 C1b C 22.0792 -22.8539
8 O6a O 29.3578 -22.8305
9 O6a O 28.1534 -24.9294
10 C6a C 20.8691 -23.5555
11 O6a O 19.6530 -22.8599
12 O6a O 20.8748 -24.9528
BOND 11
1 1 2 1
2 1 3 2
3 2 4 2
4 3 5 1
5 3 6 1
6 4 7 1
7 5 8 1
8 5 9 2
9 7 10 1
10 10 11 1
11 10 12 2
|
|---|
