SMIRKS
[O:2]=[C:3]1:[C:4]([H:39]):[C:5]([H:40]):[N:6]([C@:7]2([H:41])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:42])[O:15][C@@:16]3([H:43])[C@:17]([O:18][H:44])([H:45])[C@@:19]([N:20]4:[C:21]([H:46]):[C:22]([H:47]):[C:23](=[O:24]):[N:25]([H:48]):[C:26]:4=[O:27])([H:49])[O:28][C@@:29]3([C:30]([O:31][H:50])([H:51])[H:52])[H:53])([H:54])[H:55])([H:56])[C@:32]([O:33][H:57])([H:58])[C@:34]2([O:35][H:59])[H:60]):[C:36](=[O:37]):[N:38]:1[H:61].[H][O:1][H:62]>>[H][O:11][C:10]([C@@:9]1([H:56])[O:8][C@:7]([N:6]2:[C:5]([H:40]):[C:4]([H:39]):[C:3](=[O:2]):[N:38]([H:61]):[C:36]:2=[O:37])([H:41])[C@@:34]([O:35][H:59])([H:60])[C@@:32]1([O:33][H:57])[H:58])([H:54])[H:55].[O:1]([P:12](=[O:13])([O:14][H:42])[O:15][C@@:16]1([H:43])[C@:17]([O:18][H:44])([H:45])[C@@:19]([N:20]2:[C:21]([H:46]):[C:22]([H:47]):[C:23](=[O:24]):[N:25]([H:48]):[C:26]:2=[O:27])([H:49])[O:28][C@@:29]1([C:30]([O:31][H:50])([H:51])[H:52])[H:53])[H:62]
Derived Operators
EVODEX.1-E211 - Reaction Operator E
[#8:14](-[#6@@:13])-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[#8:39](-[H:64])-[H]>>[#8:14](-[#6@@:13])-[H].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]-[H:64]
EVODEX.1-C22 - Reaction Operator C
([#8:10]-[#15:11].[#6@:15]-[#6@:17]).[H]-[#8:35]>>([H]-[#8:10].[#6@@:17]-[#6@@:15]).[#15:11]-[#8:35]
EVODEX.1-N1369 - Reaction Operator N
[#6:14](-[#6@@:13]-[#6@:24](-[#8:25])(-[H:39])-[#6@:26](-[#6@:11])(-[#8:27])-[H:41])-[#8:15]-[#15:16](=[#8:17])(-[#8:18])-[#8:19].[H]-[#8:28]-[H:44]>>[H]-[#8:15]-[#6:14]-[#6@@:13]-[#6@:24](-[#6@:26](-[#6@:11])(-[#8:27])-[H:41])(-[#8:25])-[H:39].[#15:16](=[#8:17])(-[#8:18])(-[#8:19])-[#8:28]-[H:44]
EVODEX.1-Em615 - Reaction Operator Em
[#6:13]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:39]>>[H]-[#8:14]-[#6:13].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]
EVODEX.1-Nm550 - Reaction Operator Nm
[#6:13]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:39]>>[H]-[#8:14]-[#6:13].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]
Source Full Reactions
EVODEX.1-R4992
[O:2]=[C:3]1:[C:4]([H:39]):[C:5]([H:40]):[N:6]([C@:7]2([H:41])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:42])[O:15][C@@:16]3([H:43])[C@:17]([O:18][H:44])([H:45])[C@@:19]([N:20]4:[C:21]([H:46]):[C:22]([H:47]):[C:23](=[O:24]):[N:25]([H:48]):[C:26]:4=[O:27])([H:49])[O:28][C@@:29]3([C:30]([O:31][H:50])([H:51])[H:52])[H:53])([H:54])[H:55])([H:56])[C@:32]([O:33][H:57])([H:58])[C@:34]2([O:35][H:59])[H:60]):[C:36](=[O:37]):[N:38]:1[H:61].[H][O:1][H:62]>>[H][O:11][C:10]([C@@:9]1([H:56])[O:8][C@:7]([N:6]2:[C:5]([H:40]):[C:4]([H:39]):[C:3](=[O:2]):[N:38]([H:61]):[C:36]:2=[O:37])([H:41])[C@@:34]([O:35][H:59])([H:60])[C@@:32]1([O:33][H:57])[H:58])([H:54])[H:55].[O:1]([P:12](=[O:13])([O:14][H:42])[O:15][C@@:16]1([H:43])[C@:17]([O:18][H:44])([H:45])[C@@:19]([N:20]2:[C:21]([H:46]):[C:22]([H:47]):[C:23](=[O:24]):[N:25]([H:48]):[C:26]:2=[O:27])([H:49])[O:28][C@@:29]1([C:30]([O:31][H:50])([H:51])[H:52])[H:53])[H:62]