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
Abediterol
O=c1ccc2c(C(O)CNCCCCCCOCC(F)(F)c3ccccc3)ccc(O)c2[nH]1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
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NCC(O)c1ccc(O)c2[nH]c(=O)ccc12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 2
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NCC(O)C1=CC2OC2(O)c2[nH]c(=O)ccc21
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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
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NCC(O)C1=CC(=O)OC(O)c2[nH]c(=O)ccc21
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Show metabolites
*OC1OC(=O)C=C(C(O)CN)c2ccc(=O)[nH]c21 |$GlcA;;;;;;;;;;;;;;;;;;$|
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glucuronidation · 0.50