SMIRKS
[C:1]([C:2](=[O:3])[C:4](=[O:5])[O:6][H:16])([H:17])([H:18])[H:19].[H][C@:10]([C:8]([C:7]([H:30])([H:31])[H:32])([C:9]([H:20])([H:21])[H:22])[H:29])([N:11]([H:23])[H:24])[C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27]>>[H][C@:2]([C:1]([H:17])([H:18])[H:19])([C:4](=[O:5])[O:6][H:16])[N:11]([H:23])[H:24].[O:3]=[C:10]([C:8]([C:7]([H:30])([H:31])[H:32])([C:9]([H:20])([H:21])[H:22])[H:29])[C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27]
Derived Operators
EVODEX.1-E273 - Reaction Operator E
[#7:40](-[#6@:39](-[#6@@:5])(-[#6@:37])-[H])(-[H:70])-[H:71].[#6:45]-[#6:46](=[#8:47])-[#6:48]=[#8:49]>>[#6:39](-[#6@@:5])(-[#6@:37])=[#8:47].[#7:40](-[#6@@:46](-[#6:45])(-[#6:48]=[#8:49])-[H])(-[H:70])-[H:71]
EVODEX.1-C14 - Reaction Operator C
[H]-[#6@@:14]-[#7:13].[#6:8]=[#8:9]>>[H]-[#6@:8]-[#7:13].[#8:9]=[#6:14]
EVODEX.1-N20 - Reaction Operator N
[H]-[#6@@:14](-[#7:13](-[H:37])-[H:38])(-[#6:15])-[#6:21].[#6:7]-[#6:8](=[#8:9])-[#6:10]>>[H]-[#6@:8](-[#6:7])(-[#6:10])-[#7:13](-[H:37])-[H:38].[#8:9]=[#6:14](-[#6:15])-[#6:21]
EVODEX.1-Em544 - Reaction Operator Em
[H]-[#6:14](-[#7:13])(-[#6:15])-[#6:21].[#6:7]-[#6:8](=[#8:9])-[#6:10]=[#8:11]>>[H]-[#6:8](-[#6:7])(-[#6:10]=[#8:11])-[#7:13].[#8:9]=[#6:14](-[#6:15])-[#6:21]
EVODEX.1-Cm49 - Reaction Operator Cm
[H]-[#6:14]-[#7:13].[#6:8]=[#8:9]>>[H]-[#6:8]-[#7:13].[#8:9]=[#6:14]
EVODEX.1-Nm75 - Reaction Operator Nm
[H]-[#6:14](-[#7:13])(-[#6:15])-[#6:21].[#6:7]-[#6:8](=[#8:9])-[#6:10]>>[H]-[#6:8](-[#6:7])(-[#6:10])-[#7:13].[#8:9]=[#6:14](-[#6:15])-[#6:21]
Source Full Reactions
EVODEX.1-R3581
[C:1]([C:2](=[O:3])[C:4](=[O:5])[O:6][H:16])([H:17])([H:18])[H:19].[H][C@:10]([C:8]([C:7]([H:30])([H:31])[H:32])([C:9]([H:20])([H:21])[H:22])[H:29])([N:11]([H:23])[H:24])[C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27]>>[H][C@:2]([C:1]([H:17])([H:18])[H:19])([C:4](=[O:5])[O:6][H:16])[N:11]([H:23])[H:24].[O:3]=[C:10]([C:8]([C:7]([H:30])([H:31])[H:32])([C:9]([H:20])([H:21])[H:22])[H:29])[C:12]([C:13](=[O:14])[O:15][H:25])([H:26])[H:27]