| Entry |
|
|---|
| Name |
Tetrachlorohydroquinone;
2,3,5,6-Tetrachlorohydroquinone
|
|---|
| Formula |
C6H2Cl4O2
|
|---|
| Exact mass |
245.8809
|
|---|
| Mol weight |
247.88
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00361 | Chlorocyclohexane and chlorobenzene degradation |
| map01120 | Microbial metabolism in diverse environments |
| map05208 | Chemical carcinogenesis - reactive oxygen species |
|
|---|
| Network |
nt06251 CYP-mediated ROS formation (cancer) |
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 12
1 C8y C 28.8337 -18.3569
2 C8y C 27.6284 -17.6452
3 C8y C 30.0581 -17.6452
4 O1a O 28.8337 -19.7480
5 C8y C 27.6284 -16.2348
6 X Cl 26.4165 -18.3376
7 C8y C 30.0581 -16.2348
8 X Cl 31.2698 -18.3376
9 C8y C 28.8337 -15.5359
10 X Cl 26.4230 -15.5359
11 X Cl 31.2635 -15.5359
12 O1a O 28.8337 -14.1447
BOND 12
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 5 9 2
9 5 10 1
10 7 11 1
11 9 12 1
12 7 9 1
|
|---|
