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EVODEX.1-R5088

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
213876 CDP-ethanolamine + H2O = CMP + phosphoethanolamine False Homo sapiens Q92484 uniprot 3.1.4.12

Derived Partial Reactions

EVODEX.1-P3627

[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(N2:C([H]):C([H]):C(N([H])[H]):N:C:2=O)O[C@]1([H])C([H])([H])OP(=O)(O[H])[O:8][P:5]([O:4][C:3]([C:2]([N:1]([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])(=[O:6])[O:7][H:38]>>[H][O:8][P:5]([O:4][C:3]([C:2]([N:1]([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])(=[O:6])[O:7][H:38]

[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(N2:C([H]):C([H]):C(N([H])[H]):N:C:2=O)O[C@]1([H])C([H])([H])OP(=O)(O[H])[O:8][P:5]([O:4][C:3]([C:2]([N:1]([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])(=[O:6])[O:7][H:38]>>[H][O:8][P:5]([O:4][C:3]([C:2]([N:1]([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])(=[O:6])[O:7][H:38]