SMIRKS
[O:11]=[C:12]1[C:13]([H:19])=[C:14]([H:20])[C:15](=[O:16])[C:17]([H:21])=[C:18]1[H:22].[H][C@@:9]1([O:10][H])[C:2](=[O:1])[C:3]([O:4][H:23])([H:24])[O:5][C:6]([H:25])([H:26])[C@:7]1([O:8][H:27])[H:28]>>[O:1]=[C:2]1[C:3]([O:4][H:23])([H:24])[O:5][C:6]([H:25])([H:26])[C@:7]([O:8][H:27])([H:28])[C:9]1=[O:10].[H][O:11][C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([O:16][H]):[C:17]([H:21]):[C:18]:1[H:22]
Derived Operators
EVODEX.1-C72 - Reaction Operator C
([#8:1].[#8:6]).[H]-[#6@:13]-[#8:14]-[H]>>[#6:13]=[#8:14].([H]-[#8:1].[#8:6]-[H])
EVODEX.1-N83 - Reaction Operator N
([#8:1]=[#6:2].[#6:5]=[#8:6]).[H]-[#6@:13](-[#6@:11])(-[#8:14]-[H])-[#6@:15]>>[#6:13](-[#6@:11])(=[#8:14])-[#6@:15].([H]-[#8:1]-[#6:2].[#6:5]-[#8:6]-[H])
EVODEX.1-Em190 - Reaction Operator Em
[#8:13]=[#6:14]1-[#6:15]=[#6:16]-[#6:17](=[#8:18])-[#6:19]=[#6:20]-1.[H]-[#6:5](-[#6:2]=[#8:1])(-[#8:6]-[H])-[#6:7]>>[#8:1]=[#6:2]-[#6:5](=[#8:6])-[#6:7].[H]-[#8:13]-[#6:14]1:[#6:15]:[#6:16]:[#6:17](-[#8:18]-[H]):[#6:19]:[#6:20]:1
EVODEX.1-Cm76 - Reaction Operator Cm
([#8:1].[#8:6]).[H]-[#6:13]-[#8:14]-[H]>>[#6:13]=[#8:14].([H]-[#8:1].[#8:6]-[H])
EVODEX.1-Nm98 - Reaction Operator Nm
([#8:1]=[#6:2].[#6:5]=[#8:6]).[H]-[#6:13](-[#6:11])(-[#8:14]-[H])-[#6:15]>>[#6:11]-[#6:13](=[#8:14])-[#6:15].([H]-[#8:1]-[#6:2].[#6:5]-[#8:6]-[H])
Source Full Reactions
EVODEX.1-R224
[O:11]=[C:12]1[C:13]([H:19])=[C:14]([H:20])[C:15](=[O:16])[C:17]([H:21])=[C:18]1[H:22].[H][C@@:9]1([O:10][H])[C:2](=[O:1])[C:3]([O:4][H:23])([H:24])[O:5][C:6]([H:25])([H:26])[C@:7]1([O:8][H:27])[H:28]>>[O:1]=[C:2]1[C:3]([O:4][H:23])([H:24])[O:5][C:6]([H:25])([H:26])[C@:7]([O:8][H:27])([H:28])[C:9]1=[O:10].[H][O:11][C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([O:16][H]):[C:17]([H:21]):[C:18]:1[H:22]