Substrate
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Generation 1
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Generation 2
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
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
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Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O[PH](=O)O)C(O)C1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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NC12ON1C=Nc1c2ncn1C1OC(COP(=O)(O)O[PH](=O)O)C(O)C1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
dealkylation
Probability 0.64
0.64
dealkylation
Probability 0.57
0.57
dealkylation
Probability 0.57
0.57
dealkylation
Probability 0.57
0.57
dealkylation
Probability 0.52
0.52
((sup 13)n)ammonia
Showing 5 of 13 metabolites
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