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EVODEX.1-R5370

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([C@@:5]1([H:34])[C@:6]([O:7][C:8]2:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:2[H:39])([H:40])[O:14][C@@:15]([C:16]([O:17][H:41])([H:42])[H:43])([H:44])[C@@:18]([O:19][H:45])([H:46])[C@@:20]1([O:21][C@:22]1([H:47])[O:23][C@@:24]([C:25]([O:26][H:48])([H:49])[H:50])([H:51])[C@@:27]([O:28][H:52])([H:53])[C@@:29]([O:30][H:54])([H:55])[C@:31]1([O:32][H:56])[H:57])[H:58])[H:59])([H:60])([H:61])[H:62].[H][O:33][H:63]>>[C:1]([C:2](=[O:3])[N:4]([C@@:5]1([H:34])[C@@:6]([O:33][H:63])([H:40])[O:14][C@@:15]([C:16]([O:17][H:41])([H:42])[H:43])([H:44])[C@@:18]([O:19][H:45])([H:46])[C@@:20]1([O:21][C@:22]1([H:47])[O:23][C@@:24]([C:25]([O:26][H:48])([H:49])[H:50])([H:51])[C@@:27]([O:28][H:52])([H:53])[C@@:29]([O:30][H:54])([H:55])[C@:31]1([O:32][H:56])[H:57])[H:58])[H:59])([H:60])([H:61])[H:62].[H][O:7][C:8]1:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:1[H:39]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
233447 Galbeta(1-3)GalNAcalpha(1-)OC6H5 + H2O = Galbeta(1-3)GalNAc + phenol False Streptococcus pneumoniae nan 3.2.1.97

Derived Partial Reactions

EVODEX.1-P4534

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@@]2([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([O:7][C:8]3:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:3[H:39])[C@]2([H])N([H])C(=O)C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H]>>[H][O:7][C:8]1:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:1[H:39]

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@@]2([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([O:7][C:8]3:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:3[H:39])[C@]2([H])N([H])C(=O)C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H]>>[H][O:7][C:8]1:[C:9]([H:35]):[C:10]([H:36]):[C:11]([H:37]):[C:12]([H:38]):[C:13]:1[H:39]