Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Actinodaphnine
COc1cc2c(cc1O)CC1NCCc3cc4c(c-2c31)OCO4
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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Generation 1
Show metabolites
COC12C=C3C(=CC1(O)O2)CC1NCCc2cc4c(c3c21)OCO4
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Show metabolites
COC12C=C3C(=CC1(O)O2)CC(=O)c1c(CCN)cc2c(c13)OCO2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Show metabolites
COC12C=C3C(=CC1(O)O2)CC(=O)C1=C3C(=O)C(=O)C=C1CCN
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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gsh
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protein
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cyanide
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dna
Generation 4
Select a metabolite to form the next generation.
dna
Probability 0.09
0.09
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protein
Probability 0.08
0.08
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glutathionation
Probability 0.06
0.06
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cyanide
Probability 0.00
0.00
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