Substrate
/
Generation 1
XenoSite
Atisine
C=C1C2CCC3(CCC4C5(C)CCCC4(C4OCCN4C5)C3C2)C1O
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
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C=C1C2CCC3(CCC4C5(C)CCCC4(C(OCC=O)NC5)C3C2)C1O
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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.
hydrogenation
Probability 0.41
0.41
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epoxidation
Probability 0.18
0.18
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dealkylation
Probability 0.14
0.14
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dealkylation
Probability 0.14
0.14
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Glyoxylic acid
dealkylation
Probability 0.14
0.14
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Glyoxal
Showing 5 of 113 metabolites
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