Aclacinomycin s

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Aclacinomycin s Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)c2c(cc3c(=O)c4ccc(=O)c(=O)c=4c(=O)c3c2[O-])C1C(=O)OC UGT Conjugation prediction

Generation 2

glucuronidation · 0.33

*OC1CC(OC2C(C)OC(OC3CC(O)(CC)C(C(=O)OC)c4cc5c(=O)c6ccc(=O)c(=O)c=6c(=O)c5c([O-])c43)CC2[NH+](C)C)OC(C)C1O |$GlcA;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|