Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Bathophenanthroline disulfonic acid
O=S(=O)(O)c1ccc(-c2ccnc3c2ccc2c(-c4ccc(S(=O)(=O)O)cc4)ccnc23)cc1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
O=C1C=C(c2ccc(S(=O)(=O)O)cc2)c2ccc3c(c2=N1)=NC(=O)C=C3c1ccc(S(=O)(=O)O)cc1
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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 2
Show metabolites
O=C1C=C(c2ccc(S(=O)(=O)O)cc2)c2ccc3c(c2=N1)=NCC=C3c1ccc(S(=O)(=O)O)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Show metabolites
*C1C=C2C(c3ccc(S(=O)(=O)O)cc3)=CCN=C2c2[nH]c(=O)cc(-c3ccc(S(=O)(=O)O)cc3)c21 |$CN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
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cyanide · 0.00