SMIRKS
[H]N(C(=O)C([H])([H])[H])[C@@]([H])(C(=O)[N:9]([C@:10]([C:11]([H:19])([H:20])[H:21])([C:12](=[O:13])[O:14][H:22])[H:23])[H:24])C([H])([H])[H]>>[H][N:9]([C@:10]([C:11]([H:19])([H:20])[H:21])([C:12](=[O:13])[O:14][H:22])[H:23])[H:24]
Derived Operators
EVODEX.1-F241 - Elemental Balance
O | -2 |
C | -5 |
N | -1 |
H | -7 |
EVODEX.1-M298 - Mass Difference
-113.04771
EVODEX.1-E965 - Reaction Operator E
[#6](-[#6](=[#8])-[#7](-[#6@@](-[#6](-[H])(-[H])-[H])(-[#6](=[#8])-[#7:9](-[#6@@:10])-[H:71])-[H])-[H])(-[H])(-[H])-[H]>>[#7:9](-[#6@@:10])(-[H:71])-[H]
EVODEX.1-C608 - Reaction Operator C
[H]-[#7](-[#6](=[#8])-[#6](-[H])(-[H])-[H])-[#6@](-[H])(-[#6](=[#8])-[#7:9])-[#6](-[H])(-[H])-[H]>>[H]-[#7:9]
EVODEX.1-N765 - Reaction Operator N
[H]-[#7](-[#6](=[#8])-[#6](-[H])(-[H])-[H])-[#6@](-[H])(-[#6](=[#8])-[#7:9](-[#6@:10])-[H:28])-[#6](-[H])(-[H])-[H]>>[H]-[#7:9](-[#6@:10])-[H:28]
Source Full Reactions
EVODEX.1-R5669
[C:1]([C:2](=[O:3])[N:4]([C@:5]([C:6]([H:16])([H:17])[H:18])([C:7](=[O:8])[N:9]([C@:10]([C:11]([H:19])([H:20])[H:21])([C:12](=[O:13])[O:14][H:22])[H:23])[H:24])[H:25])[H:26])([H:27])([H:28])[H:29].[H][O:15][H:30]>>[C:1]([C:2](=[O:3])[N:4]([C@:5]([C:6]([H:16])([H:17])[H:18])([C:7](=[O:8])[O:15][H:30])[H:25])[H:26])([H:27])([H:28])[H:29].[H][N:9]([C@:10]([C:11]([H:19])([H:20])[H:21])([C:12](=[O:13])[O:14][H:22])[H:23])[H:24]