Input help
reaction_identifier | substrate_cofactor_name | product_name | substrate_cofactor_smiles | product_smiles |
DM1 | brivudine | bromovinyluracil | OC[C@H]1O[C@H](C[C@@H]1O)N1C=C(\C=C\Br)C(=O)NC1=O | Br\C=C\C1=CNC(=O)NC1=O |
DM2 | gemcitabine | 2′, 2′-difluorodeoxyuridine | NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](CO)[C@@H](O)C1(F)F.O.[H+] | OC[C@H]1O[C@@H](N2C=CC(=O)NC2=O)C(F)(F)[C@@H]1O.[NH4+] |
DM3 | foo | bar | C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)N | O=C(CS(=O)(N)=O)C1=CC=CC=C1O |