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EVODEX.1-R5371

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([C@:5]1([H:38])[C:6]([O:7][C@:8]2([H:39])[O:9][C@@:10]([C:11]([O:12][H:40])([H:41])[H:42])([H:43])[C@@:13]([O:14][H:44])([H:45])[C@@:15]([O:16][H:46])([H:47])[C@:17]2([O:18][H:48])[H:49])([H:50])[C@:19]([O:20][H:51])([H:52])[C@:21]([C:22]([O:23][H:53])([H:54])[H:55])([H:56])[O:24][C@@:25]1([O:26][C:27]1:[C:28]([H:57]):[C:29]([H:58]):[C:30]([N+:31](=[O:32])[O-:33]):[C:34]([H:59]):[C:35]:1[H:60])[H:61])[H:62])([H:63])([H:64])[H:65].[H][O:37][C:36]([H:67])([H:68])[H:69]>>[C:1]([C:2](=[O:3])[N:4]([C@:5]1([H:38])[C:6]([O:7][C@:8]2([H:39])[O:9][C@@:10]([C:11]([O:12][H:40])([H:41])[H:42])([H:43])[C@@:13]([O:14][H:44])([H:45])[C@@:15]([O:16][H:46])([H:47])[C@:17]2([O:18][H:48])[H:49])([H:50])[C@:19]([O:20][H:51])([H:52])[C@:21]([C:22]([O:23][H:53])([H:54])[H:55])([H:56])[O:24][C@@:25]1([O:37][C:36]([H:67])([H:68])[H:69])[H:61])[H:62])([H:63])([H:64])[H:65].[H][O:26][C:27]1:[C:28]([H:57]):[C:29]([H:58]):[C:30]([N+:31](=[O:32])[O-:33]):[C:34]([H:59]):[C:35]:1[H:60]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
233455 beta-D-Gal-(1-3)-alpha-D-GalNAc-(1-O)-p-nitrophenyl + methanol = beta-D-Gal-(1-3)-alpha-D-GalNAc-(1-O)-methyl + p-nitrophenol False Bacillus sp. (in: Bacteria) nan 3.2.1.97

Derived Partial Reactions

EVODEX.1-P4535

[H][O:37][C:36]([H:67])([H:68])[H:69]>>[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(OC2([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([O:37][C:36]([H:67])([H:68])[H:69])[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:37][C:36]([H:67])([H:68])[H:69]>>[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(OC2([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([O:37][C:36]([H:67])([H:68])[H:69])[C@]2([H])N([H])C(=O)C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H]