SMIRKS
[C:1]([C:2]1([C:3]([H:27])([H:28])[H:29])[S:4][C@:5]2([H:30])[C@@:6]([N:7]([H:31])[H:32])([H:33])[C:8](=[O:9])[N:10]2[C@:11]1([C:12](=[O:13])[O:14][H:34])[H:35])([H:36])([H:37])[H:38].[H][N:15]([C:16](=[O:17])[C@:18]([N:19]([H:39])[H:40])([C:20]1:[C:21]([H:41]):[C:22]([H:42]):[C:23]([O:24][H:43]):[C:25]([H:44]):[C:26]:1[H:45])[H:46])[H:47]>>[C:1]([C:2]1([C:3]([H:27])([H:28])[H:29])[S:4][C@:5]2([H:30])[C@@:6]([N:15]([C:16](=[O:17])[C@:18]([N:19]([H:39])[H:40])([C:20]3:[C:21]([H:41]):[C:22]([H:42]):[C:23]([O:24][H:43]):[C:25]([H:44]):[C:26]:3[H:45])[H:46])[H:47])([H:33])[C:8](=[O:9])[N:10]2[C@:11]1([C:12](=[O:13])[O:14][H:34])[H:35])([H:36])([H:37])[H:38].[H][N:7]([H:31])[H:32]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
253242 | D-4-hydroxyphenylglycine amide + 6-aminopenicillanic acid = amoxicillin + NH3 {r} | False | Escherichia coli | nan | 3.5.1.11 |
Derived Partial Reactions
EVODEX.1-P5487
[H]N([H])[C@@:6]1([H:33])[C@@:5]2([H:30])[S:4][C:2]([C:1]([H:36])([H:37])[H:38])([C:3]([H:27])([H:28])[H:29])[C@@:11]([C:12](=[O:13])[O:14][H:34])([H:35])[N:10]2[C:8]1=[O:9].[H][N:15]([C:16](=[O:17])[C@:18]([N:19]([H:39])[H:40])([C:20]1:[C:21]([H:41]):[C:22]([H:42]):[C:23]([O:24][H:43]):[C:25]([H:44]):[C:26]:1[H:45])[H:46])[H:47]>>[C:1]([C:2]1([C:3]([H:27])([H:28])[H:29])[S:4][C@:5]2([H:30])[C@@:6]([N:15]([C:16](=[O:17])[C@:18]([N:19]([H:39])[H:40])([C:20]3:[C:21]([H:41]):[C:22]([H:42]):[C:23]([O:24][H:43]):[C:25]([H:44]):[C:26]:3[H:45])[H:46])[H:47])([H:33])[C:8](=[O:9])[N:10]2[C@:11]1([C:12](=[O:13])[O:14][H:34])[H:35])([H:36])([H:37])[H:38]