Substrate
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Generation 1
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Generation 2
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
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CN(C)C1C(O)=C(C(N)=O)C(=O)C2(O)C(O)=C3C(=O)C4=C(C(=O)C(=O)C=C4O)C(C)(O)C3CC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CN(C)C1C2CC3C(=C(O)C2(O)C(=O)C2(C(N)=O)OC12O)C(=O)C1=C(C(=O)C(=O)C=C1O)C3(C)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 0.15
0.15
protein
Probability 0.06
0.06
glutathionation
Probability 0.04
0.04
glutathionation
Probability 0.01
0.01
dna
Probability 0.00
0.00
Showing 5 of 8 metabolites
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