Substrate
/
Generation 1
XenoSite
Atropine
C[NH+]1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
Formic acid
O=CO
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Select a metabolite to form the next generation.
hydrolysis
Probability 0.02
0.02
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Formaldehyde
hydrolysis
Probability 0.02
0.02
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15o
hydrolysis
Probability 0.02
0.02
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Formic acid
dehydration
Probability 0.00
0.00
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Formaldehyde
dehydration
Probability 0.00
0.00
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15o
Showing 5 of 6 metabolites
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