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EVODEX.1-R4952

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
200825 4-nitrophenyl 4-O-(E)-feruloyl-alpha-D-xylopyranoside + H2O = 4-nitrophenyl-alpha-D-xylopyranoside + trans-ferulate False Talaromyces stipitatus nan 3.1.1.73

Derived Partial Reactions

EVODEX.1-P4112

[H]OC1:C([H]):C([H]):C(C([H])=C([H])C(=O)[O:10][C@:11]2([H:35])[C:12]([H:36])([H:37])[O:13][C@@:14]([O:15][C:16]3:[C:17]([H:38]):[C:18]([H:39]):[C:19]([N+:20](=[O:21])[O-:22]):[C:23]([H:40]):[C:24]:3[H:41])([H:42])[C@@:25]([O:26][H:43])([H:44])[C@:27]2([O:28][H:45])[H:46]):C([H]):C:1OC([H])([H])[H]>>[H][O:10][C@:11]1([H:35])[C:12]([H:36])([H:37])[O:13][C@@:14]([O:15][C:16]2:[C:17]([H:38]):[C:18]([H:39]):[C:19]([N+:20](=[O:21])[O-:22]):[C:23]([H:40]):[C:24]:2[H:41])([H:42])[C@@:25]([O:26][H:43])([H:44])[C@:27]1([O:28][H:45])[H:46]

[H]OC1:C([H]):C([H]):C(C([H])=C([H])C(=O)[O:10][C@:11]2([H:35])[C:12]([H:36])([H:37])[O:13][C@@:14]([O:15][C:16]3:[C:17]([H:38]):[C:18]([H:39]):[C:19]([N+:20](=[O:21])[O-:22]):[C:23]([H:40]):[C:24]:3[H:41])([H:42])[C@@:25]([O:26][H:43])([H:44])[C@:27]2([O:28][H:45])[H:46]):C([H]):C:1OC([H])([H])[H]>>[H][O:10][C@:11]1([H:35])[C:12]([H:36])([H:37])[O:13][C@@:14]([O:15][C:16]2:[C:17]([H:38]):[C:18]([H:39]):[C:19]([N+:20](=[O:21])[O-:22]):[C:23]([H:40]):[C:24]:2[H:41])([H:42])[C@@:25]([O:26][H:43])([H:44])[C@:27]1([O:28][H:45])[H:46]