XenoSite

Amrubicin

CHEBI
Phase 1ReactivityEpoxidationQuinonationN-DealkylationUGT Conjugation
Amrubicin Quinonation prediction
CC(=O)C1(N)C=c2c(O)c3c(c(O)c2=C(OC2CC(O)C(O)CO2)C1)C(=O)c1ccccc1C3=O Epoxidation prediction
CC(=O)C1(N)C=C2C(O)=C3C(=O)c4ccccc4C(=O)C3=C(O)C23OC3(OC2CC(O)C(O)CO2)C1 stable oxygenation prediction
CC(=O)C1(N)C=C2C(O)=C3C(=O)c4ccccc4C(=O)C3=C(O)C23OC3(OC2CC(O)C(O)CO2)C1 unstable oxygenation prediction
CC(=O)C1(N)C=C2C(O)=C3C(=O)c4ccccc4C(=O)C3=C(O)C23OC3(OC2CC(O)C(O)CO2)C1 dehydrogenation prediction
CC(=O)C1(N)C=C2C(O)=C3C(=O)c4ccccc4C(=O)C3=C(O)C23OC3(OC2CC(O)C(O)CO2)C1 reduction prediction
CC(=O)C1(N)C=C2C(O)=C3C(=O)c4ccccc4C(=O)C3=C(O)C23OC3(OC2CC(O)C(O)CO2)C1 hydrolysis prediction

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