Substrate
/
Generation 1
/
Generation 2
XenoSite
Austocystin d
CC(C)(O)CCc1ccc(O)c2c(=O)c3c(O)c4c(cc3oc12)OC1OC=CC41O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(C)(O)CCC1=CC2OC2(O)c2c1oc1cc3c(c(O)c1c2=O)C1(O)C=COC1O3
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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
CC(C)(O)CCC1=CC2OC2(O)c2c1oc1cc3c(c(O)c1c2=O)C(O)(C=CO)C(=O)O3
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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.
glucuronidation
Probability 0.35
0.35
glucuronidation
Probability 0.30
0.30
glucuronidation
Probability 0.14
0.14
glucuronidation
Probability 0.04
0.04
glucuronidation
Probability 0.02
0.02