SMIRKS
[H][C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7](=[C:6]([C:5]([C:4](=[C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])[H:47])[H:46])([H:44])[H:45])[H:43])[H:42])([H:40])[H:41])[H:39])[H:38])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([H:28])[H:29])([H:26])[H:27])([C:18](=[O:19])[O:20][H:23])[H:24]>>[H]OO[C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7](=[C:6]([C:5]([C:4](=[C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])[H:47])[H:46])([H:44])[H:45])[H:43])[H:42])([H:40])[H:41])[H:39])[H:38])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([H:28])[H:29])([H:26])[H:27])([C:18](=[O:19])[O:20][H:23])[H:24]
Derived Operators
EVODEX.1-M19 - Mass Difference
31.9898
EVODEX.1-E602 - Reaction Operator E
[#6:3]-[#6:4](-[#6:5])(-[H:44])-[H]>>[#6:3]-[#6:4](-[#6:5])(-[#8]-[#8]-[H])-[H:44]
EVODEX.1-N138 - Reaction Operator N
[H]-[#6:12](-[#6:11])(-[#6:13])-[H:34]>>[H]-[#8]-[#8]-[#6:12](-[#6:11])(-[#6:13])-[H:34]
EVODEX.1-Em221 - Reaction Operator Em
[H]-[#6:12](-[#6:11])-[#6:13]>>[#8]-[#8]-[#6:12](-[#6:11])-[#6:13]
EVODEX.1-Nm220 - Reaction Operator Nm
[H]-[#6:12](-[#6:11])-[#6:13]>>[#8]-[#8]-[#6:12](-[#6:11])-[#6:13]
Source Full Reactions
EVODEX.1-R307
[H][C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7](=[C:6]([C:5]([C:4](=[C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])[H:47])[H:46])([H:44])[H:45])[H:43])[H:42])([H:40])[H:41])[H:39])[H:38])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([H:28])[H:29])([H:26])[H:27])([C:18](=[O:19])[O:20][H:23])[H:24].[O:21]=[O:22]>>[H][O:22][O:21][C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7](=[C:6]([C:5]([C:4](=[C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])[H:47])[H:46])([H:44])[H:45])[H:43])[H:42])([H:40])[H:41])[H:39])[H:38])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([H:28])[H:29])([H:26])[H:27])([C:18](=[O:19])[O:20][H:23])[H:24]