SMIRKS
[C:1]([C:2]1:[C:3]([H:19]):[C:4]([H:20]):[C:5]([C@@:6]2([H:21])[O:7][C@:8]2([C:9]2:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:2[H:28])[H:29]):[C:16]([H:30]):[C:17]:1[H:31])([H:32])([H:33])[H:34].[H][O:18][H:35]>>[H][O:7][C@:8]([C@@:6]([C:5]1:[C:4]([H:20]):[C:3]([H:19]):[C:2]([C:1]([H:32])([H:33])[H:34]):[C:17]([H:31]):[C:16]:1[H:30])([O:18][H:35])[H:21])([C:9]1:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:1[H:28])[H:29]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
236181 | cis-4,4'-dimethylstilbene oxide + H2O = (1R,2R)-1,2-bis(4-methylphenyl)ethane-1,2-diol | False | Oryctolagus cuniculus | nan | 3.3.2.9 |
Derived Partial Reactions
EVODEX.1-P4567
[C:1]([C:2]1:[C:3]([H:19]):[C:4]([H:20]):[C:5]([C@@:6]2([H:21])[O:7][C@:8]2([C:9]2:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:2[H:28])[H:29]):[C:16]([H:30]):[C:17]:1[H:31])([H:32])([H:33])[H:34].[H][O:18][H:35]>>[H][O:7][C@:8]([C@@:6]([C:5]1:[C:4]([H:20]):[C:3]([H:19]):[C:2]([C:1]([H:32])([H:33])[H:34]):[C:17]([H:31]):[C:16]:1[H:30])([O:18][H:35])[H:21])([C:9]1:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:1[H:28])[H:29]
EVODEX.1-P4568
[C:1]([C:2]1:[C:3]([H:19]):[C:4]([H:20]):[C:5]([C@@:6]2([H:21])[O:7][C@:8]2([C:9]2:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:2[H:28])[H:29]):[C:16]([H:30]):[C:17]:1[H:31])([H:32])([H:33])[H:34]>>[H]O[C@:6]([C:5]1:[C:4]([H:20]):[C:3]([H:19]):[C:2]([C:1]([H:32])([H:33])[H:34]):[C:17]([H:31]):[C:16]:1[H:30])([C@@:8]([O:7][H])([C:9]1:[C:10]([H:22]):[C:11]([H:23]):[C:12]([C:13]([H:24])([H:25])[H:26]):[C:14]([H:27]):[C:15]:1[H:28])[H:29])[H:21]