Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Chlortetracycline
CN(C)C1C(O)=C(C(N)=O)C(=O)C2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4C(C)(O)C3CC12
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CNC1C(O)=C(C(N)=O)C(=O)C2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4C(C)(O)C3CC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CNC1C(O)=C(C(N)=O)C(=O)C2(O)C(O)=C3C(=O)C4=C(C(Cl)=CC(=O)C4=O)C(C)(O)C3CC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
CNC1C(O)=C(C(N)=O)C(=O)C2(O)C1CC1C(C)(O)C3=C(C(=O)C(=O)C=C3Cl)C(=O)C13OC23O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
glucuronidation
Probability 0.32
0.32
glucuronidation
Probability 0.02
0.02
glucuronidation
Probability 0.01
0.01
glucuronidation
Probability 0.00
0.00