Substrate
/
Generation 1
/
Generation 2
XenoSite
Atropine
C[NH+]1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
C[NH+]1C2CCC1CC(OC(=O)C(CO)=C1C=CC(=O)C=C1)C2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
Methanol
CO
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
Select a metabolite to form the next generation.
hydroxylation
Probability 0.04
0.04
Methandiol
dehydration
Probability 0.00
0.00
Tennesine hydride
dehydration
Probability 0.00
0.00
15o
dehydrogenation
Probability 0.00
0.00
Formaldehyde