SMIRKS
[H]N([H])[C@@:7]([H])([C:6]([C:5]([C:3]([O:2][C:1]([H:26])([H:27])[H:28])=[O:4])([H:24])[H:25])([H:22])[H:23])[C:9](=[O:10])[O:11][C:12]([H:18])([H:19])[H:20]>>O=[C:7]([C:6]([C:5]([C:3]([O:2][C:1]([H:26])([H:27])[H:28])=[O:4])([H:24])[H:25])([H:22])[H:23])[C:9](=[O:10])[O:11][C:12]([H:18])([H:19])[H:20]
Derived Operators
EVODEX.1-F72 - Elemental Balance
| O | 1 |
| N | -1 |
| H | -3 |
EVODEX.1-M60 - Mass Difference
-1.0316900000000002
EVODEX.1-N42 - Reaction Operator N
[H]-[#7](-[H])-[#6@@:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]
EVODEX.1-Em340 - Reaction Operator Em
[H]-[#7](-[H])-[#6:8](-[H])(-[#6:7])-[#6:10]=[#8:11]>>[#8]=[#6:8](-[#6:7])-[#6:10]=[#8:11]
EVODEX.1-Nm115 - Reaction Operator Nm
[H]-[#7](-[H])-[#6:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]
Source Full Reactions
EVODEX.1-R953
[H][C@@:7]([C:6]([C:5]([C:3]([O:2][C:1]([H:26])([H:27])[H:28])=[O:4])([H:24])[H:25])([H:22])[H:23])([N:8]([H:16])[H:17])[C:9](=[O:10])[O:11][C:12]([H:18])([H:19])[H:20].[O:14]=[O:15].[H][O:13][H]>>[C:1]([O:2][C:3](=[O:4])[C:5]([C:6]([C:7]([C:9](=[O:10])[O:11][C:12]([H:18])([H:19])[H:20])=[O:13])([H:22])[H:23])([H:24])[H:25])([H:26])([H:27])[H:28].[H][N:8]([H:16])[H:17].[H][O:14][O:15][H]