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EVODEX.1-R6875

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C:2](=[O:1])[C:3]1:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:1[O:10][C:11]([C:12]([C:13]([O:14][C:15]1:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:1[C:22](=[O:23])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[H][O:23][C@@:22]1([H:30])[C:2](=[O:1])[C:3]2:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:2[O:10][C:11]([H:35])([H:36])[C:12]([H:33])([H:34])[C:13]([H:31])([H:32])[O:14][C:15]2:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:21

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
282645 2,2'-[propane-1,3-diylbis(oxy)]bis(3-chlorobenzaldehyde) = (15R)-4,10-dichloro-15-hydroxy-7,8-dihydro-6H-dibenzo[f,j][1 5]dioxacycloundecin-14(15H)-one False Pseudomonas fluorescens nan 4.1.2.38

Derived Partial Reactions

EVODEX.1-P6271

[H][C:2](=[O:1])[C:3]1:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:1[O:10][C:11]([C:12]([C:13]([O:14][C:15]1:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:1[C:22](=[O:23])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[H][O:23][C@@:22]1([H:30])[C:2](=[O:1])[C:3]2:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:2[O:10][C:11]([H:35])([H:36])[C:12]([H:33])([H:34])[C:13]([H:31])([H:32])[O:14][C:15]2:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:21

[H][C:2](=[O:1])[C:3]1:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:1[O:10][C:11]([C:12]([C:13]([O:14][C:15]1:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:1[C:22](=[O:23])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[H][O:23][C@@:22]1([H:30])[C:2](=[O:1])[C:3]2:[C:4]([H:24]):[C:5]([H:25]):[C:6]([H:26]):[C:7]([Cl:8]):[C:9]:2[O:10][C:11]([H:35])([H:36])[C:12]([H:33])([H:34])[C:13]([H:31])([H:32])[O:14][C:15]2:[C:16]([Cl:17]):[C:18]([H:27]):[C:19]([H:28]):[C:20]([H:29]):[C:21]:21