SMIRKS
[H]N([H])[C:8]([H])([C:7]([C:6]([C:5]([N:4]([C:2]([C:1]([H:24])([H:25])[H:26])=[O:3])[H:23])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[H:15].[H][O:10][H]>>[C:1]([C:2](=[O:3])[N:4]([C:5]([C:6]([C:7]([C:8](=[O:10])[H:15])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])[H:23])([H:24])([H:25])[H:26]
Derived Operators
EVODEX.1-F71 - Elemental Balance
| N | -1 |
| H | -5 |
EVODEX.1-M59 - Mass Difference
-19.04225
EVODEX.1-E618 - Reaction Operator E
[#6:2]-[#6:4](-[#7](-[H])-[H])(-[H:12])-[H].[#8:6](-[H])-[H]>>[#6:2]-[#6:4](=[#8:6])-[H:12]
EVODEX.1-N235 - Reaction Operator N
[H]-[#7](-[H])-[#6:4](-[H])(-[#6:2])-[H:12].[H]-[#8:6]-[H]>>[#6:2]-[#6:4](=[#8:6])-[H:12]
EVODEX.1-Em350 - Reaction Operator Em
[H]-[#7](-[H])-[#6:4](-[H])-[#6:2].[H]-[#8:6]-[H]>>[#6:2]-[#6:4]=[#8:6]
EVODEX.1-Nm317 - Reaction Operator Nm
[H]-[#7](-[H])-[#6:4](-[H])-[#6:2].[H]-[#8:6]-[H]>>[#6:2]-[#6:4]=[#8:6]
Source Full Reactions
EVODEX.1-R919
[H][C:8]([C:7]([C:6]([C:5]([N:4]([C:2]([C:1]([H:24])([H:25])[H:26])=[O:3])[H:23])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])([N:9]([H:13])[H:14])[H:15].[O:11]=[O:12].[H][O:10][H]>>[C:1]([C:2](=[O:3])[N:4]([C:5]([C:6]([C:7]([C:8](=[O:10])[H:15])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])[H:23])([H:24])([H:25])[H:26].[H][N:9]([H:13])[H:14].[H][O:11][O:12][H]