Substrate
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Generation 1
XenoSite
Andrastin e
COC(=O)C12C([O-])=C(C)C(=O)C1(C)C(C)=CC1C3(C)CCC(O)C(C)(C)C3CCC12C
CHEBI
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Description
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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 1
Show metabolites
CC1=CC2C3(C)CCC(O)C(C)(C)C3CCC2(C)C2(C(=O)O)C([O-])=C(C)C(=O)C12C
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Select a metabolite to form the next generation.
epoxidation
Probability 0.16
0.16
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epoxidation
Probability 0.16
0.16
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epoxidation
Probability 0.16
0.16
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epoxidation
Probability 0.02
0.02
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epoxidation
Probability 0.00
0.00
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