Substrate
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Generation 1
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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)c1ccc(N=c2cc3n(-c4ccccc4)c4ccccc4nc-3c3c2C2OC2(S(=O)(=O)O)C=C3)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
O=C1C=CC=CC1=[n+]1c2c(nc3ccccc31)C1=C(C(=Nc3ccc(S(=O)(=O)O)cc3)C=2)C2OC2(S(=O)(=O)O)C=C1
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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 0.35
0.35
dna
Probability 0.11
0.11
dna
Probability 0.10
0.10
protein
Probability 0.08
0.08
protein
Probability 0.02
0.02
Showing 5 of 20 metabolites
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