SMIRKS
[C:1](=[C:2]([O:3][C:4](=[O:5])[C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])[H:40])[H:41])([H:42])[H:43]>>[H]O[C:2](=[C:1]([H:42])[H:43])[H:41].[H][O:3][C:4](=[O:5])[C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])[H:40]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E354 - Reaction Operator E
[#6:1]=[#6:2](-[#8:3]-[#6:4])-[H:27]>>[#6:1]=[#6:2](-[#8]-[H])-[H:27].[#8:3](-[#6:4])-[H]
EVODEX.1-N622 - Reaction Operator N
[#6:1]=[#6:2](-[#8:3]-[#6:4])-[H:27]>>[H]-[#8]-[#6:2](=[#6:1])-[H:27].[H]-[#8:3]-[#6:4]
EVODEX.1-Em592 - Reaction Operator Em
[#6:1]=[#6:2]-[#8:3]-[#6:4]>>[H]-[#8]-[#6:2]=[#6:1].[H]-[#8:3]-[#6:4]
EVODEX.1-Nm531 - Reaction Operator Nm
[#6:1]=[#6:2]-[#8:3]-[#6:4]>>[H]-[#8]-[#6:2]=[#6:1].[H]-[#8:3]-[#6:4]
Source Full Reactions
EVODEX.1-R4780
[C:1](=[C:2]([O:3][C:4](=[O:5])[C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])[H:40])[H:41])([H:42])[H:43].[H][O:17][H:44]>>[C:1](=[C:2]([O:17][H:44])[H:41])([H:42])[H:43].[H][O:3][C:4](=[O:5])[C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])[H:40]