Substrate
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Generation 1
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Generation 2
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Generation 3
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Generation 4
XenoSite
Acetylcaranine
CC(=O)OC1CC=C2CCN3Cc4cc5c(cc4C1C23)OCO5
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(=O)OC1CC=C(CC(=O)O)C2NCc3cc4c(cc3C12)OCO4
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CC(=O)OC1CC=C(CC(=O)O)C2NCC34OC3C3=C(C=C4C12)OCO3
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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 3
Show metabolites
O=C(O)CC1=CCC(O)C2C3=CC4=C(OCO4)C4OC34CNC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 4
Show metabolites
*C1C2=C(C=C3C4C(O)CC=C(CC(=O)O)C4NCC31O)OCO2 |$DNA;;;;;;;;;;;;;;;;;;;;;;;$|
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dna · 0.04