SMIRKS
[H][O:5][C:4]1([H:43])[O:3][C@:2]([C:1]([H:50])([H:51])[H:52])([H:41])[C@:10]([O:11][H:48])([H:49])[C@:8]([O:9][H:46])([H:47])[C@@:6]1([O:7][H:44])[H:45].[O:12]=[C:13]1:[C:14]([H:53]):[C:15]([H:54]):[N:16]([C@:17]2([H:55])[O:18][C@@:19]([C:20]([O:21][P:22](=[O:23])([O:24][H:56])[O:25][P:26](=[O:27])([O:28][H:57])[O:29][P:30](=[O:31])([O:32][H:58])[O:33][H:59])([H:60])[H:61])([H:62])[C@:34]([O:35][H:63])([H:64])[C@:36]2([O:37][H:65])[H:66]):[C:38](=[O:39]):[N:40]:1[H:67]>>[C:1]([C@:2]1([H:41])[O:3][C@@:4]([O:5][P:30](=[O:31])([O:32][H:58])[O:33][H:59])([H:43])[C@:6]([O:7][H:44])([H:45])[C@@:8]([O:9][H:46])([H:47])[C@@:10]1([O:11][H:48])[H:49])([H:50])([H:51])[H:52].[H][O:29][P:26]([O:25][P:22]([O:21][C:20]([C@@:19]1([H:62])[O:18][C@:17]([N:16]2:[C:15]([H:54]):[C:14]([H:53]):[C:13](=[O:12]):[N:40]([H:67]):[C:38]:2=[O:39])([H:55])[C@@:36]([O:37][H:65])([H:66])[C@@:34]1([O:35][H:63])[H:64])([H:60])[H:61])(=[O:23])[O:24][H:56])(=[O:27])[O:28][H:57]
Derived Operators
EVODEX.1-E290 - Reaction Operator E
[#15:16]-[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:23].[#8:32](-[#6:33](-[H:62])(-[#8:34])-[#6@:44])-[H]>>[#15:16]-[#8:19]-[H].[#15:20](=[#8:21])(-[#8:22])(-[#8:23])-[#8:32]-[#6@@:33](-[H:62])(-[#8:34])-[#6@:44]
EVODEX.1-C880 - Reaction Operator C
[H]-[#8:5]-[#6:4]-[#6@@:6]-[#6@:8]-[#6@:10].([#8:32]-[#15:33].[#6@:37]-[#6@:39])>>[#8:5](-[#6@@:4]-[#6@:6]-[#6@@:8]-[#6@@:10])-[#15:33].([H]-[#8:32].[#6@@:39]-[#6@@:37])
EVODEX.1-N1225 - Reaction Operator N
[H]-[#8:5]-[#6:4]1(-[H:46])-[#8:3]-[#6@:2]-[#6@:10](-[#8:11])(-[H:52])-[#6@:8](-[#8:9])(-[H:50])-[#6@@:6]-1(-[#8:7])-[H:48].([#15:29]-[#8:32]-[#15:33](=[#8:34])(-[#8:35])-[#8:36].[#8:38]-[#6@@:37](-[#6@@:22])(-[H:66])-[#6@:39](-[#6@:20])(-[#8:40])-[H:68])>>[#8:3]1-[#6@:2]-[#6@:10](-[#6@:8](-[#6@@:6](-[#6@:4]-1(-[#8:5]-[#15:33](=[#8:34])(-[#8:35])-[#8:36])-[H:46])(-[#8:7])-[H:48])(-[#8:9])-[H:50])(-[#8:11])-[H:52].([H]-[#8:32]-[#15:29].[#8:40]-[#6@:39](-[#6@:20])(-[H:68])-[#6@@:37](-[#6@@:22])(-[#8:38])-[H:66])
EVODEX.1-Em16 - Reaction Operator Em
[#15:23]-[#8:26]-[#15:27](=[#8:28])(-[#8:29])-[#8:30].[H]-[#8:65]-[#6:66]>>[H]-[#8:26]-[#15:23].[#15:27](=[#8:28])(-[#8:29])(-[#8:30])-[#8:65]-[#6:66]
EVODEX.1-Nm19 - Reaction Operator Nm
[#15:23]-[#8:26]-[#15:27](=[#8:28])(-[#8:29])-[#8:30].[H]-[#8:65]-[#6:66]>>[H]-[#8:26]-[#15:23].[#15:27](=[#8:28])(-[#8:29])(-[#8:30])-[#8:65]-[#6:66]
Source Full Reactions
EVODEX.1-R4075
[H][O:5][C:4]1([H:43])[O:3][C@:2]([C:1]([H:50])([H:51])[H:52])([H:41])[C@:10]([O:11][H:48])([H:49])[C@:8]([O:9][H:46])([H:47])[C@@:6]1([O:7][H:44])[H:45].[O:12]=[C:13]1:[C:14]([H:53]):[C:15]([H:54]):[N:16]([C@:17]2([H:55])[O:18][C@@:19]([C:20]([O:21][P:22](=[O:23])([O:24][H:56])[O:25][P:26](=[O:27])([O:28][H:57])[O:29][P:30](=[O:31])([O:32][H:58])[O:33][H:59])([H:60])[H:61])([H:62])[C@:34]([O:35][H:63])([H:64])[C@:36]2([O:37][H:65])[H:66]):[C:38](=[O:39]):[N:40]:1[H:67]>>[C:1]([C@:2]1([H:41])[O:3][C@@:4]([O:5][P:30](=[O:31])([O:32][H:58])[O:33][H:59])([H:43])[C@:6]([O:7][H:44])([H:45])[C@@:8]([O:9][H:46])([H:47])[C@@:10]1([O:11][H:48])[H:49])([H:50])([H:51])[H:52].[H][O:29][P:26]([O:25][P:22]([O:21][C:20]([C@@:19]1([H:62])[O:18][C@:17]([N:16]2:[C:15]([H:54]):[C:14]([H:53]):[C:13](=[O:12]):[N:40]([H:67]):[C:38]:2=[O:39])([H:55])[C@@:36]([O:37][H:65])([H:66])[C@@:34]1([O:35][H:63])[H:64])([H:60])[H:61])(=[O:23])[O:24][H:56])(=[O:27])[O:28][H:57]