Arisugacin d

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Arisugacin d Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

COC1=CC=C(c2cc3c(c(=O)o2)CC2(O)C(C)(CCC4(O)C(C)(C)C(OC(C)=O)CCC24C)O3)C2OC12 gsh prediction

COC1=CC=C(c2cc3c(c(=O)o2)CC2(O)C(C)(CCC4(O)C(C)(C)C(OC(C)=O)CCC24C)O3)C2OC12 protein prediction

COC1=CC=C(c2cc3c(c(=O)o2)CC2(O)C(C)(CCC4(O)C(C)(C)C(OC(C)=O)CCC24C)O3)C2OC12 cyanide prediction

COC1=CC=C(c2cc3c(c(=O)o2)CC2(O)C(C)(CCC4(O)C(C)(C)C(OC(C)=O)CCC24C)O3)C2OC12 dna prediction

Generation 2

Select a metabolite to form the next generation.