Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Actinorhodin
CC1OC(CC(=O)[O-])Cc2c(O)c3c(c([O-])c21)C(=O)C(C1=CC(=O)c2c(O)c4c(c(O)c2C1=O)C(C)OC(CC(=O)[O-])C4)=CC3=O
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
Show metabolites
CC1OC(CC(=O)[O-])Cc2c(O)c3c(c([O-])c21)C(=O)C(c1cc(=O)c2c(=O)c4c(c(=O)c=2c1=O)C(C)OC(CC(=O)[O-])C4)=CC3=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CC1OC(CC(=O)[O-])CC2=C1C(=O)C1=C([O-])C3(c4cc(=O)c5c(=O)c6c(c(=O)c=5c4=O)C(C)OC(CC(=O)[O-])C6)OC3C(=O)C1=C2O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
*OC(=O)CC1Cc2c(c(=O)c3c(=O)c(C45OC4C(=O)C4=C(O)C6=C(C(=O)C4=C5[O-])C(C)OC(CC(=O)[O-])C6)cc(=O)c=3c2=O)C(C)O1 |$GlcA;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
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glucuronidation · 0.05