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EVODEX.1-R4854

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
197213 octanol + decanoate = octyl decanoate + H2O False Rhizomucor miehei P19515 uniprot 3.1.1.3

Derived Partial Reactions

EVODEX.1-P4008

[H][O:21][C:20]([C:19]([C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([H:37])([H:38])[H:39])([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24]>>[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:21][C:20]([C:19]([C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([H:37])([H:38])[H:39])([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24]

[H][O:21][C:20]([C:19]([C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([H:37])([H:38])[H:39])([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24]>>[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:21][C:20]([C:19]([C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([H:37])([H:38])[H:39])([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24]