SMIRKS
[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[N:8]([C@:9]1([H:23])[C:10](=[O:11])[N:12]2[C@:13]1([H:24])[S:14][C:15]([C:16]([H:25])([H:26])[H:27])([C:17]([H:28])([H:29])[H:30])[C@@:18]2([C:19](=[O:20])[O:21][H:31])[H:32])[H:33])([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44].[H][O:22][H:45]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[O:22][H:45])([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44].[H][N:8]([C@:9]1([H:23])[C:10](=[O:11])[N:12]2[C@:13]1([H:24])[S:14][C:15]([C:16]([H:25])([H:26])[H:27])([C:17]([H:28])([H:29])[H:30])[C@@:18]2([C:19](=[O:20])[O:21][H:31])[H:32])[H:33]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
253026 | penicillin dihydroF + H2O = 6-aminopenicillanic acid + hexanoic acid | False | Actinoplanes utahensis | nan | 3.5.1.11 |
Derived Partial Reactions
EVODEX.1-P5446
[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[N:8]([C@:9]1([H:23])[C:10](=[O:11])[N:12]2[C@:13]1([H:24])[S:14][C:15]([C:16]([H:25])([H:26])[H:27])([C:17]([H:28])([H:29])[H:30])[C@@:18]2([C:19](=[O:20])[O:21][H:31])[H:32])[H:33]>>[H][N:8]([C@:9]1([H:23])[C:10](=[O:11])[N:12]2[C@:13]1([H:24])[S:14][C:15]([C:16]([H:25])([H:26])[H:27])([C:17]([H:28])([H:29])[H:30])[C@@:18]2([C:19](=[O:20])[O:21][H:31])[H:32])[H:33]
EVODEX.1-P5447
[H]OC(=O)[C@]1([H])N2C(=O)[C@@]([H])(N([H])[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])=[O:7])[C@@]2([H])SC1(C([H])([H])[H])C([H])([H])[H].[H][O:22][H:45]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[O:22][H:45])([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44]
EVODEX.1-P5448
[H]OC(=O)[C@]1([H])N2C(=O)[C@@]([H])(N([H])[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])=[O:7])[C@@]2([H])SC1(C([H])([H])[H])C([H])([H])[H]>>[H]O[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])=[O:7]