Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Adenylyl-molybdopterin
Nc1nc2c(c(=O)[nH]1)NC1C(S)=C(S)C(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)OC1N2
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
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Molybdopterin
Nc1nc2c(c(=O)[nH]1)NC1C(S)=C(S)C(COP(=O)(O)O)OC1N2
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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Nc1nc2c(c(=O)[nH]1)=NC1C(S)=C(S)C(COP(=O)(O)O)OC1N=2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
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NC12NC(=O)C3=NC4C(S)=C(S)C(COP(=O)(O)O)OC4N=C3N1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
dealkylation
Probability 0.79
0.79
dealkylation
Probability 0.64
0.64
dealkylation
Probability 0.63
0.63
((sup 13)n)ammonia
dealkylation
Probability 0.63
0.63
dealkylation
Probability 0.30
0.30
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