SMIRKS
[H][O:6][C@@:5]([C:4]([C:3]([C:2]([C:1]([H:23])([H:24])[H:25])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])([C:7]#[N:8])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16]>>[C:1]([C:2]([C:3]([C:4]([C:5](=[O:6])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])([H:24])[H:25].[H][C:7]#[N:8]
Source Database Data
| Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
|---|---|---|---|---|---|---|
| 283397 | cyanide + heptan-3-one = (2S)-2-ethyl-2-hydroxyhexanenitrile | False | Manihot esculenta | P52705 | uniprot | 4.1.2.47 |
Derived Partial Reactions
EVODEX.1-P6349
![[H][O:6][C@:5](C#N)([C:4]([C:3]([C:2]([C:1]([H:23])([H:24])[H:25])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16]>>[C:1]([C:2]([C:3]([C:4]([C:5](=[O:6])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])([H:24])[H:25]](../images/EVODEX.1-P6349.svg)
[H][O:6][C@:5](C#N)([C:4]([C:3]([C:2]([C:1]([H:23])([H:24])[H:25])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16]>>[C:1]([C:2]([C:3]([C:4]([C:5](=[O:6])[C:9]([C:10]([H:12])([H:13])[H:14])([H:15])[H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])([H:24])[H:25]