Substrate
/
Generation 1
/
Generation 2
XenoSite
Atropine
CN1C2CCC1CC(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
About this model
Generation 1
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Norhyoscyamine
O=C(OC1CC2CCC(C1)N2)C(CO)c1ccccc1
CHEBI
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Show metabolites
O=C(OC1CC2=NC(CC2)C1)C(CO)c1ccccc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
quinone formation
Probability 0.00
0.00
quinone formation
Probability 0.00
0.00
quinone formation
Probability 0.00
0.00
quinone formation
Probability 0.00
0.00
quinone formation
Probability 0.00
0.00