SMIRKS
[H][O:14][C:13]1:[C:12]([C:2](=[O:1])[C:3](=[C:4]([C:5]2:[C:6]([H:21]):[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]:2[F:11])[H:25])[H:26]):[C:19]([O:20][H:31]):[C:18]([H:30]):[C:16]([O:17][H:29]):[C:15]:1[H:28]>>[H][C:3]1([H:26])[C:2](=[O:1])[C:12]2:[C:13](:[C:15]([H:28]):[C:16]([O:17][H:29]):[C:18]([H:30]):[C:19]:2[O:20][H:31])[O:14][C@:4]1([C:5]1:[C:6]([H:21]):[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]:1[F:11])[H:25]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
310709 | (2E)-3-(2-fluorophenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one = (2R)-2-(2-fluorophenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one | False | Scutellaria baicalensis | nan | 5.5.1.6 |
Derived Partial Reactions
EVODEX.1-P6599
[H][O:14][C:13]1:[C:12]([C:2](=[O:1])[C:3](=[C:4]([C:5]2:[C:6]([H:21]):[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]:2[F:11])[H:25])[H:26]):[C:19]([O:20][H:31]):[C:18]([H:30]):[C:16]([O:17][H:29]):[C:15]:1[H:28]>>[H][C:3]1([H:26])[C:2](=[O:1])[C:12]2:[C:13](:[C:15]([H:28]):[C:16]([O:17][H:29]):[C:18]([H:30]):[C:19]:2[O:20][H:31])[O:14][C@:4]1([C:5]1:[C:6]([H:21]):[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]:1[F:11])[H:25]