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EVODEX.1-R5120

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
216260 rac-octan-3-yl sulfate + H2O = (3S)-octan-3-ol + sulfate False Sulfolobus acidocaldarius nan 3.1.6.19

Derived Partial Reactions

EVODEX.1-P4273

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

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

EVODEX.1-P4274

[H]OS(=O)(=O)O[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:30])([H:31])[H:32])([H:28])[H:29])([H:26])[H:27])([H:24])[H:25])([H:22])[H:23])([C:7]([C:8]([H:15])([H:16])[H:17])([H:18])[H:19])[H:21]>>[H]O[C@:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:30])([H:31])[H:32])([H:28])[H:29])([H:26])[H:27])([H:24])[H:25])([H:22])[H:23])([C:7]([C:8]([H:15])([H:16])[H:17])([H:18])[H:19])[H:21]

[H]OS(=O)(=O)O[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:30])([H:31])[H:32])([H:28])[H:29])([H:26])[H:27])([H:24])[H:25])([H:22])[H:23])([C:7]([C:8]([H:15])([H:16])[H:17])([H:18])[H:19])[H:21]>>[H]O[C@:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:30])([H:31])[H:32])([H:28])[H:29])([H:26])[H:27])([H:24])[H:25])([H:22])[H:23])([C:7]([C:8]([H:15])([H:16])[H:17])([H:18])[H:19])[H:21]