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
hydrogenation · 0.08
CC1OC(CC(=O)[O-])C=C2C1=C(O)C1=C(C(=O)C=C(C3=CC(=O)c4c(O)c5c(c([O-])c4C3=O)C(C)OC(CC(=O)[O-])C5)C1=O)C2O
Probability scale from 0.0 to 1.0