XenoSite

Aclacinomycin s

CHEBI
Phase 1ReactivityEpoxidationQuinonationN-DealkylationUGT Conjugation
Aclacinomycin s Quinonation prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C(=O)OC)C(=O)c1cccc(O)c1C3=O stable oxygenation prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C(=O)OC)C(=O)c1cccc(O)c1C3=O unstable oxygenation prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C(=O)OC)C(=O)c1cccc(O)c1C3=O dehydrogenation prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C(=O)OC)C(=O)c1cccc(O)c1C3=O reduction prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C(=O)OC)C(=O)c1cccc(O)c1C3=O hydrolysis prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C2=C([O-])C3=C(C(=O)C2=C1C=O)C(=O)c1cccc(O)c1C3=O Epoxidation prediction
CCC1(O)CC(OC2CC([NH+](C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)C23OC2([O-])C2=C(C(=O)C3=C1C=O)C(=O)c1cccc(O)c1C2=O UGT Conjugation prediction
glucuronidation · 0.61
*Oc1cccc2c1C(=O)C1=C(C(=O)C3=C(C=O)C(O)(CC)CC(OC4CC([NH+](C)C)C(OC5CC(O)C(O)C(C)O5)C(C)O4)C34OC14[O-])C2=O |$GlcA;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Probability scale from 0.0 to 1.0