XenoSite

Actinorhodin

CHEBI
Phase 1ReactivityEpoxidationQuinonationN-DealkylationUGT Conjugation
Actinorhodin Quinonation prediction
CC1OC(CC(=O)[O-])C=C2C(=O)C3=C(C(=O)C(C4=CC(=O)c5c(O)c6c(c([O-])c5C4=O)C(C)OC(CC(=O)[O-])C6)=CC3=O)C(O)=C21 stable oxygenation prediction
CC1OC(CC(=O)[O-])C=C2C(=O)C3=C(C(=O)C(C4=CC(=O)c5c(O)c6c(c([O-])c5C4=O)C(C)OC(CC(=O)[O-])C6)=CC3=O)C(O)=C21 unstable oxygenation prediction
CC1OC(CC(=O)[O-])C=C2C(=O)C3=C(C(=O)C(C4=CC(=O)c5c(O)c6c(c([O-])c5C4=O)C(C)OC(CC(=O)[O-])C6)=CC3=O)C(O)=C21 dehydrogenation prediction
CC1OC(CC(=O)[O-])C=C2C(=O)C3=C(C(=O)C(C4=CC(=O)c5c(O)c6c(c([O-])c5C4=O)C(C)OC(CC(=O)[O-])C6)=CC3=O)C(O)=C21 reduction prediction
CC1OC(CC(=O)[O-])C=C2C(=O)C3=C(C(=O)C(C4=CC(=O)c5c(O)c6c(c([O-])c5C4=O)C(C)OC(CC(=O)[O-])C6)=CC3=O)C(O)=C21 hydrolysis prediction

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