Substrate
/
Generation 1
/
Generation 2
XenoSite
Bathophenanthroline disulfonic acid
O=S(=O)(O)c1ccc(-c2ccnc3c2ccc2c(-c4ccc(S(=O)(=O)O)cc4)ccnc23)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
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O=S(=O)(O)c1ccc(C2=c3ccc4c(-c5ccc(S(=O)(=O)O)cc5)ccnc4c3=NC3OC23)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
O=C1N=c2c(ccc3c2=NC2OC2C=3c2ccc(S(=O)(=O)O)cc2)=C(c2ccc(S(=O)(=O)O)cc2)C1=O
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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 0.30
0.30
dna
Probability 0.19
0.19
protein
Probability 0.13
0.13
glutathionation
Probability 0.09
0.09
glutathionation
Probability 0.08
0.08
Showing 5 of 8 metabolites
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