| Entry |
|
|---|
| Name |
Benzene oxide;
Arene oxide
|
|---|
| Formula |
C6H6O
|
|---|
| Exact mass |
94.0419
|
|---|
| Mol weight |
94.1112
|
|---|
| Structure |
|
|---|
| Pathway |
| map05208 | Chemical carcinogenesis - reactive oxygen species |
|
|---|
| Network |
nt06251 CYP-mediated ROS formation (cancer) |
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 7
1 C1y C 22.6838 -16.8500
2 C1y C 22.6838 -15.4648
3 O2x O 23.9619 -16.2392
4 C2x C 21.4810 -17.5489
5 C2x C 21.4810 -14.7785
6 C2x C 20.2974 -16.8500
7 C2x C 20.2974 -15.4648
BOND 8
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 4 6 2
6 5 7 2
7 2 3 1
8 6 7 1
|
|---|
