Substrate
/
Generation 1
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Generation 2
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Generation 3
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
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Show metabolites
O=C1C=CC(=C(CO)C(=O)OC2CC3CCC(C2)N3)C=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Show metabolites
*C1C=C(O)C=CC1=C(CO)C(=O)OC1CC2CCC(C1)N2 |$GSH;;;;;;;;;;;;;;;;;;;;;$|
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glutathionation · 0.05