Substrate
/
Generation 1
/
Generation 2
XenoSite
Azocarmine g free acid
O=S(=O)(O)c1ccc(N=c2cc3n(-c4ccccc4)c4ccccc4nc-3c3ccc(S(=O)(=O)O)cc23)cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
O=S(=O)(O)c1ccc2c3nc4ccccc4n(-c4ccccc4)c-3cc(=NC3=CC4OC4(S(=O)(=O)O)C=C3)c2c1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
O=S(=O)(O)c1ccc2c3nc4ccccc4[nH]c-3cc(=NC3=CC4OC4(S(=O)(=O)O)C=C3)c2c1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
dna
Probability 0.21
0.21
glutathionation
Probability 0.11
0.11
protein
Probability 0.08
0.08
dna
Probability 0.04
0.04
glutathionation
Probability 0.03
0.03
Showing 5 of 20 metabolites
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