Substrate
/
Generation 1
XenoSite
Aristoloterpenate i
COc1cccc2c1cc([N+](=O)[O-])c1c(C(=O)OC3C=C(C=O)CCC=C(C)CCC=C(C)C3)cc3c(c12)OCO3
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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Nitrite
O=N[O-]
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.07
0.07
Aminooxidanide
dehydration
Probability 0.07
0.07
15o
hydrogenation
Probability 0.07
0.07
nitrogen reduction
Probability 0.07
0.07
((sup 13)n)ammonia
nitrogen reduction
Probability 0.07
0.07
((sup 13)n)ammonia
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