SMIRKS
[H]N([H])[C:6]([H])([C:5]([C:4]([C:2]([C:1]([H:26])([H:27])[H:28])([C:3]([H:12])([H:13])[H:14])[H:25])([H:23])[H:24])([H:21])[H:22])[C:7]([H:15])([H:16])[H:17].[H][O:9][H]>>[C:1]([C:2]([C:3]([H:12])([H:13])[H:14])([C:4]([C:5]([C:6]([C:7]([H:15])([H:16])[H:17])=[O:9])([H:21])[H:22])([H:23])[H:24])[H:25])([H:26])([H:27])[H:28]
Derived Operators
EVODEX.1-F71 - Elemental Balance
| N | -1 |
| H | -5 |
EVODEX.1-M59 - Mass Difference
-19.04225
EVODEX.1-E619 - Reaction Operator E
[#7](-[#6:2](-[#6:3])(-[#6:9])-[H])(-[H])-[H].[#8:15](-[H])-[H]>>[#6:2](-[#6:3])(-[#6:9])=[#8:15]
EVODEX.1-N34 - Reaction Operator N
[H]-[#7](-[H])-[#6@:2](-[H])(-[#6:1])-[#6:4].[H]-[#8:14]-[H]>>[#6:1]-[#6:2](-[#6:4])=[#8:14]
EVODEX.1-Em358 - Reaction Operator Em
[H]-[#7](-[H])-[#6:2](-[H])(-[#6:1])-[#6:4].[H]-[#8:14]-[H]>>[#6:1]-[#6:2](-[#6:4])=[#8:14]
EVODEX.1-Nm106 - Reaction Operator Nm
[H]-[#7](-[H])-[#6:2](-[H])(-[#6:1])-[#6:4].[H]-[#8:14]-[H]>>[#6:1]-[#6:2](-[#6:4])=[#8:14]
Source Full Reactions
EVODEX.1-R938
[H][C:6]([C:5]([C:4]([C:2]([C:1]([H:26])([H:27])[H:28])([C:3]([H:12])([H:13])[H:14])[H:25])([H:23])[H:24])([H:21])[H:22])([C:7]([H:15])([H:16])[H:17])[N:8]([H:18])[H:19].[O:10]=[O:11].[H][O:9][H]>>[C:1]([C:2]([C:3]([H:12])([H:13])[H:14])([C:4]([C:5]([C:6]([C:7]([H:15])([H:16])[H:17])=[O:9])([H:21])[H:22])([H:23])[H:24])[H:25])([H:26])([H:27])[H:28].[H][N:8]([H:18])[H:19].[H][O:10][O:11][H]