SMIRKS
O=C([N:1]([H:23])[H:24])[N:4]([C@:5]([C:6]([C:7]([C:8](=[O:9])[O:10][H:15])([H:16])[H:17])([H:18])[H:19])([C:11](=[O:12])[O:13][H:20])[H:21])[H:22]>>[H][N:4]([C@:5]([C:6]([C:7]([C:8](=[O:9])[O:10][H:15])([H:16])[H:17])([H:18])[H:19])([C:11](=[O:12])[O:13][H:20])[H:21])[H:22].[H][N:1]([H:23])[H:24]
Derived Operators
EVODEX.1-F347 - Elemental Balance
| O | -1 |
| C | -1 |
| H | 2 |
EVODEX.1-M150 - Mass Difference
-25.97924
EVODEX.1-E1136 - Reaction Operator E
[#7:1](-[#6](=[#8])-[#7:4](-[#6:5])-[H:16])(-[H:17])-[H:18]>>[#7:4](-[#6:5])(-[H:16])-[H].[#7:1](-[H:17])(-[H:18])-[H]
EVODEX.1-N854 - Reaction Operator N
[#8]=[#6](-[#7:1](-[H:23])-[H:24])-[#7:4](-[#6@:5])-[H:22]>>[H]-[#7:4](-[#6@:5])-[H:22].[H]-[#7:1](-[H:23])-[H:24]
EVODEX.1-Em668 - Reaction Operator Em
[#8]=[#6](-[#7:1])-[#7:4]-[#6:5]>>[H]-[#7:4]-[#6:5].[H]-[#7:1]
EVODEX.1-Nm601 - Reaction Operator Nm
[#8]=[#6](-[#7:1])-[#7:4]-[#6:5]>>[H]-[#7:4]-[#6:5].[H]-[#7:1]
Source Full Reactions
EVODEX.1-R6466
[N:1]([C:2](=[O:3])[N:4]([C@:5]([C:6]([C:7]([C:8](=[O:9])[O:10][H:15])([H:16])[H:17])([H:18])[H:19])([C:11](=[O:12])[O:13][H:20])[H:21])[H:22])([H:23])[H:24].[H][O:14][H]>>[C:2](=[O:3])=[O:14].[H][N:4]([C@:5]([C:6]([C:7]([C:8](=[O:9])[O:10][H:15])([H:16])[H:17])([H:18])[H:19])([C:11](=[O:12])[O:13][H:20])[H:21])[H:22].[H][N:1]([H:23])[H:24]