SMIRKS
[C:1]([C:2]1:[C:3]([H:16]):[C:4]([H:17]):[C:5]([C:6]([C:7]([C:8]#[N:9])([H:18])[H:19])([C:10]([C:11]#[N:12])([H:20])[H:21])[H:22]):[C:13]([H:23]):[C:14]:1[H:24])([H:25])([H:26])[H:27].[H][O:15][H]>>[H][N:9]([H])[C:8]([C:7]([C:6]([C:5]1:[C:4]([H:17]):[C:3]([H:16]):[C:2]([C:1]([H:25])([H:26])[H:27]):[C:14]([H:24]):[C:13]:1[H:23])([C:10]([C:11]#[N:12])([H:20])[H:21])[H:22])([H:18])[H:19])=[O:15]
Source Database Data
| Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
|---|---|---|---|---|---|---|
| 266744 | 3-(4-methylphenyl)pentanedinitrile + H2O = (3S)-4-cyano-3-(4-methylphenyl)butanoic acid | False | Synechocystis sp. PCC 6803 | Q55949 | uniprot | 3.5.5.1 |
Derived Partial Reactions
EVODEX.1-P5923
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