Arabidopside b

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Arabidopside b Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCC=CCC1C(=O)C=CC1CCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCC1C=CC(=O)C1CC1OC1CC stable oxygenation prediction

CCC=CCC1C(=O)C=CC1CCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCC1C=CC(=O)C1CC1OC1CC unstable oxygenation prediction

CCC=CCC1C(=O)C=CC1CCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCC1C=CC(=O)C1CC1OC1CC dehydrogenation prediction

CCC=CCC1C(=O)C=CC1CCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCC1C=CC(=O)C1CC1OC1CC reduction prediction

CCC=CCC1C(=O)C=CC1CCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCCCC1C=CC(=O)C1CC1OC1CC hydrolysis prediction

Generation 2

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