Rule bt0042

[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

Pattern 4168
1-Nitro-2-unsubstituted aromatic -> vic-Dihydroxyaromatic


Aerobic Likelihood:              Neutral

EAWAG-BBD Reaction(s):
2,4-Dinitrotoluene -----> 4-Methyl-5-nitrocatechol (reacID# r1501)
Nitrobenzene -----> Catechol (reacID# r0306)

Comments:
Also handles fused rings. All fused aromatic ring products with hydroxyl at 2,3 position are excluded.

Similarities:
bt0005: vic-unsubstituted Aromatic --> vic-Dihydroxyaromatic
bt0255: vic-Dihydrodihydroxyaromatic --> vic-Dihydroxyaromatic

Contact Us if you have any comments on rule bt0042.
[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

Page Author(s): Bo Kyeng Hou, Jiun-guo Yu, Rachael Long and Michael Turnbull
October 23, 2009

This is the EAWAG-BBD biotransformation rule, ruleID# bt0042.
It was generated on November 23, 2024 2:10:17 AM CST.

© 2024, EAWAG.