SMIRKS
[C:1]([S+:2]([C:3]([C:4]([C@:5]([N:6]([H:41])[H:42])([C:7](=[O:8])[O:9][H:43])[H:44])([H:45])[H:46])([H:47])[H:48])[C:10]([C@@:11]1([H:49])[O:12][C@:13]([N:14]2:[C:15]([H:50]):[N:16]:[C:17]3:[C:18]([N:19]([H:51])[H:52]):[N:20]:[C:21]([H:53]):[N:22]:[C:23]:2:3)([H:54])[C@@:24]([O:25][H:55])([H:56])[C@@:26]1([O:27][H:57])[H:58])([H:59])[H:60])([H:61])([H:62])[H:63].[H][N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70]>>[C:1]([N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70])([H:61])([H:62])[H:63].[HH].[S:2]([C:3]([C:4]([C@:5]([N:6]([H:41])[H:42])([C:7](=[O:8])[O:9][H:43])[H:44])([H:45])[H:46])([H:47])[H:48])[C:10]([C@@:11]1([H:49])[O:12][C@:13]([N:14]2:[C:15]([H:50]):[N:16]:[C:17]3:[C:18]([N:19]([H:51])[H:52]):[N:20]:[C:21]([H:53]):[N:22]:[C:23]:2:3)([H:54])[C@@:24]([O:25][H:55])([H:56])[C@@:26]1([O:27][H:57])[H:58])([H:59])[H:60]
Source Database Data
| Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
|---|---|---|---|---|---|---|
| 99380 | S-adenosyl-L-methionine + quinoline 3-carboxamide = S-adenosyl-L-homocysteine + N-methylquinoline 3-carboxamide | False | Homo sapiens | P40261 | swissprot | 2.1.1.1 |
Derived Partial Reactions
EVODEX.1-P1224
![[H]C([H])([H])[S+:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]>>[S:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]](../images/EVODEX.1-P1224.svg)
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EVODEX.1-P1225
![[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])C([H])([H])[S+](C([H])([H])[C@@]1([H])O[C@@]([H])(N2:C([H]):N:C3:C(N([H])[H]):N:C([H]):N:C:3:2)[C@]([H])(O[H])[C@]1([H])O[H])[C:1]([H:61])([H:62])[H:63].[H][N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70]>>[C:1]([N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70])([H:61])([H:62])[H:63]](../images/EVODEX.1-P1225.svg)
[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])C([H])([H])[S+](C([H])([H])[C@@]1([H])O[C@@]([H])(N2:C([H]):N:C3:C(N([H])[H]):N:C([H]):N:C:3:2)[C@]([H])(O[H])[C@]1([H])O[H])[C:1]([H:61])([H:62])[H:63].[H][N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70]>>[C:1]([N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70])([H:61])([H:62])[H:63]
EVODEX.1-P1226
![[H][N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70]>>[H]C([H])([H])[N:28]([C:29](=[O:30])[C:31]1:[C:32]([H:64]):[N:33]:[C:34]2:[C:35]([H:65]):[C:36]([H:66]):[C:37]([H:67]):[C:38]([H:68]):[C:39]:2:[C:40]:1[H:69])[H:70]](../images/EVODEX.1-P1226.svg)
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