SMIRKS
[O:2]=[C:3]([N:4]([C@@:5]1([H:20])[C:6]([O:7][H:21])([H:22])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:23])[O:15][H:24])([H:25])[H:26])([H:27])[C@:16]([O:17][H:28])([H:29])[C@@:18]1([O:19][H:30])[H:31])[H:32])[H:33]>>[H][N:4]([C@@:5]1([H:20])[C:6]([O:7][H:21])([H:22])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:23])[O:15][H:24])([H:25])[H:26])([H:27])[C@:16]([O:17][H:28])([H:29])[C@@:18]1([O:19][H:30])[H:31])[H:32].[H]O[C:3](=[O:2])[H:33]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E347 - Reaction Operator E
[#6:4]-[#7:5](-[#6:6](=[#8:7])-[H:9])-[H:10]>>[#6:4]-[#7:5](-[H:10])-[H].[#6:6](=[#8:7])(-[#8]-[H])-[H:9]
EVODEX.1-N1405 - Reaction Operator N
[#8:2]=[#6:3](-[#7:4](-[#6:5])-[H:28])-[H:29]>>[H]-[#7:4](-[#6:5])-[H:28].[H]-[#8]-[#6:3](=[#8:2])-[H:29]
EVODEX.1-Em129 - Reaction Operator Em
[#6:5]-[#7:6]-[#6:7]=[#8:8]>>[H]-[#7:6]-[#6:5].[H]-[#8]-[#6:7]=[#8:8]
EVODEX.1-Nm163 - Reaction Operator Nm
[#6:5]-[#7:6]-[#6:7]=[#8:8]>>[H]-[#7:6]-[#6:5].[H]-[#8]-[#6:7]=[#8:8]
Source Full Reactions
EVODEX.1-R6343
[O:2]=[C:3]([N:4]([C@@:5]1([H:20])[C:6]([O:7][H:21])([H:22])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:23])[O:15][H:24])([H:25])[H:26])([H:27])[C@:16]([O:17][H:28])([H:29])[C@@:18]1([O:19][H:30])[H:31])[H:32])[H:33].[H][O:1][H:34]>>[H][N:4]([C@@:5]1([H:20])[C:6]([O:7][H:21])([H:22])[O:8][C@@:9]([C:10]([O:11][P:12](=[O:13])([O:14][H:23])[O:15][H:24])([H:25])[H:26])([H:27])[C@:16]([O:17][H:28])([H:29])[C@@:18]1([O:19][H:30])[H:31])[H:32].[O:1]([C:3](=[O:2])[H:33])[H:34]