EVODEX Logo

EVODEX.1-R5423

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
236526 L-Trp-7-amido-4-methylcoumarin + H2O = L-Trp + 7-amino-4-methylcoumarin False Leishmania donovani Q95V75 swissprot 3.4.11.1

Derived Partial Reactions

EVODEX.1-P4595

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:10](=[O:11])[C@@:12]([N:13]([H:32])[H:33])([C:14]([C:15]3:[C:16]([H:34]):[N:17]([H:35]):[C:18]4:[C:19]([H:36]):[C:20]([H:37]):[C:21]([H:38]):[C:22]([H:39]):[C:23]:3:4)([H:40])[H:41])[H:42]):C([H]):C:2OC1([H])[H].[H][O:27][H:49]>>[C:10](=[O:11])([C@@:12]([N:13]([H:32])[H:33])([C:14]([C:15]1:[C:16]([H:34]):[N:17]([H:35]):[C:18]2:[C:19]([H:36]):[C:20]([H:37]):[C:21]([H:38]):[C:22]([H:39]):[C:23]:1:2)([H:40])[H:41])[H:42])[O:27][H:49]

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:10](=[O:11])[C@@:12]([N:13]([H:32])[H:33])([C:14]([C:15]3:[C:16]([H:34]):[N:17]([H:35]):[C:18]4:[C:19]([H:36]):[C:20]([H:37]):[C:21]([H:38]):[C:22]([H:39]):[C:23]:3:4)([H:40])[H:41])[H:42]):C([H]):C:2OC1([H])[H].[H][O:27][H:49]>>[C:10](=[O:11])([C@@:12]([N:13]([H:32])[H:33])([C:14]([C:15]1:[C:16]([H:34]):[N:17]([H:35]):[C:18]2:[C:19]([H:36]):[C:20]([H:37]):[C:21]([H:38]):[C:22]([H:39]):[C:23]:1:2)([H:40])[H:41])[H:42])[O:27][H:49]