SMIRKS
[O:3]([C@:4]([C:5]([S:6][H:21])([H:22])[H:23])([C@:7]([O:8][H:24])([C:9]([S:10][S:11][C:12]([C@@:13]([O:14][H:25])([C@:15]([O:16][H:26])([C:17]([S:18][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][S:10][C:9]([C@:7]([C@:4]([O:3][H:38])([C:5]([S:6][H:21])([H:22])[H:23])[H:37])([O:8][H:24])[H:36])([H:34])[H:35].[H][S:11][C:12]([C@@:13]([O:14][H:25])([C@:15]([O:16][H:26])([C:17]([S:18][H:27])([H:28])[H:29])[H:30])[H:31])([H:32])[H:33]
Derived Operators
EVODEX.1-M3 - Mass Difference
2.01566
EVODEX.1-E9 - Reaction Operator E
[#6:57]-[#16:58]-[#16:59]-[#6:60]>>[#6:57]-[#16:58]-[H].[#16:59](-[#6:60])-[H]
EVODEX.1-N1301 - Reaction Operator N
[#6:9]-[#16:10]-[#16:11]-[#6:12]>>[H]-[#16:10]-[#6:9].[H]-[#16:11]-[#6:12]
EVODEX.1-Em389 - Reaction Operator Em
[#6:9]-[#16:10]-[#16:11]-[#6:12]>>[H]-[#16:10]-[#6:9].[H]-[#16:11]-[#6:12]
EVODEX.1-Nm349 - Reaction Operator Nm
[#6:9]-[#16:10]-[#16:11]-[#6:12]>>[H]-[#16:10]-[#6:9].[H]-[#16:11]-[#6:12]
Source Full Reactions
EVODEX.1-R1155
[H][O:1][O:2][H].[O:3]([C@:4]([C:5]([S:6][H:21])([H:22])[H:23])([C@:7]([O:8][H:24])([C:9]([S:10][S:11][C:12]([C@@:13]([O:14][H:25])([C@:15]([O:16][H:26])([C:17]([S:18][H:27])([H:28])[H:29])[H:30])[H:31])([H:32])[H:33])([H:34])[H:35])[H:36])[H:37])[H:38]>>[O:1]=[O:2].[H][S:10][C:9]([C@:7]([C@:4]([O:3][H:38])([C:5]([S:6][H:21])([H:22])[H:23])[H:37])([O:8][H:24])[H:36])([H:34])[H:35].[H][S:11][C:12]([C@@:13]([O:14][H:25])([C@:15]([O:16][H:26])([C:17]([S:18][H:27])([H:28])[H:29])[H:30])[H:31])([H:32])[H:33]