SMIRKS
[H][C@@:4]1([O:5][H])[O:3][C@@:2]([C:1]([H:23])([H:24])[H:25])([H:14])[C@:10]([O:11][H:21])([H:22])[C@@:8]([O:9][H:19])([H:20])[C@:6]1([O:7][H:17])[H:18].[O:12]=[O:13]>>[C:1]([C@@:2]1([H:14])[O:3][C:4](=[O:5])[C@@:6]([O:7][H:17])([H:18])[C@:8]([O:9][H:19])([H:20])[C@@:10]1([O:11][H:21])[H:22])([H:23])([H:24])[H:25].[H][O:12][O:13][H]
Derived Operators
EVODEX.1-E196 - Reaction Operator E
[#8:1]=[#8:2].[#8:10]-[#6:11](-[#8:12]-[H])(-[H])-[#6@@:13]>>[#8:10]-[#6:11](=[#8:12])-[#6@@:13].[#8:1](-[#8:2]-[H])-[H]
EVODEX.1-C1040 - Reaction Operator C
[H]-[#6@@:4](-[#8:5]-[H])-[#6@:6]-[#6@@:8]-[#6@:10].[#8:12]=[#8:13]>>[#6:4](=[#8:5])-[#6@@:6]-[#6@:8]-[#6@@:10].[H]-[#8:12]-[#8:13]-[H]
EVODEX.1-N1292 - Reaction Operator N
[H]-[#6@@:4]1(-[#8:5]-[H])-[#8:3]-[#6@@:2]-[#6@:10](-[#8:11])(-[H:22])-[#6@@:8](-[#8:9])(-[H:20])-[#6@:6]-1(-[#8:7])-[H:18].[#8:12]=[#8:13]>>[#8:3]1-[#6@@:2]-[#6@:10](-[#6@@:8](-[#6@:6](-[#6:4]-1=[#8:5])(-[#8:7])-[H:18])(-[#8:9])-[H:20])(-[#8:11])-[H:22].[H]-[#8:12]-[#8:13]-[H]
EVODEX.1-Em183 - Reaction Operator Em
[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]
EVODEX.1-Cm63 - Reaction Operator Cm
[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]
EVODEX.1-Nm190 - Reaction Operator Nm
[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]
Source Full Reactions
EVODEX.1-R170
[H][C@@:4]1([O:5][H])[O:3][C@@:2]([C:1]([H:23])([H:24])[H:25])([H:14])[C@:10]([O:11][H:21])([H:22])[C@@:8]([O:9][H:19])([H:20])[C@:6]1([O:7][H:17])[H:18].[O:12]=[O:13]>>[C:1]([C@@:2]1([H:14])[O:3][C:4](=[O:5])[C@@:6]([O:7][H:17])([H:18])[C@:8]([O:9][H:19])([H:20])[C@@:10]1([O:11][H:21])[H:22])([H:23])([H:24])[H:25].[H][O:12][O:13][H]