Substrate
/
Generation 1
/
Generation 2
XenoSite
Austocystin d
CC(C)(O)CCc1ccc(O)c2c(=O)c3c(O)c4c(cc3oc12)OC1OC=CC41O
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(C)(O)CCc1ccc(O)c2c(=O)c3c(oc12)C(=O)C1=C(C3=O)C2(O)C=COC2O1
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CC(C)(O)CCC12OC1C=C(O)c1c2oc2c(c1=O)C(=O)C1=C(OC3OC=CC13O)C2=O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
Select a metabolite to form the next generation.
dehydration
Probability 0.18
0.18
dehydration
Probability 0.18
0.18
15o
hydrogenation
Probability 0.18
0.18
oxygen reduction
Probability 0.18
0.18
dealkylation
Probability 0.10
0.10
Showing 5 of 100 metabolites
Show all