SMIRKS
[H]OC(=O)[C@@]([H])(N([H])[C:8](=[O:9])[C:10]([C:11]([C:12]([N:13]([H:18])[H:19])([H:20])[H:21])([H:22])[H:23])([H:24])[H:25])C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])[H]>>[H]O[C:8](=[O:9])[C:10]([C:11]([C:12]([N:13]([H:18])[H:19])([H:20])[H:21])([H:22])[H:23])([H:24])[H:25]
Derived Operators
EVODEX.1-F267 - Elemental Balance
| O | -1 |
| C | -6 |
| N | -2 |
| H | -12 |
EVODEX.1-M84 - Mass Difference
-128.09506000000002
EVODEX.1-E1009 - Reaction Operator E
[#7](-[#6](-[#6](-[#6](-[#6](-[#6@](-[#7](-[#6:8](=[#8:9])-[#6:10])-[H])(-[#6](=[#8])-[#8]-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H]>>[#6:8](=[#8:9])(-[#6:10])-[#8]-[H]
EVODEX.1-C599 - Reaction Operator C
[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[#7](-[H])-[#6:8])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#7](-[H])-[H]>>[H]-[#8]-[#6:8]
EVODEX.1-N756 - Reaction Operator N
[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[#7](-[H])-[#6:8](=[#8:9])-[#6:10])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#7](-[H])-[H]>>[H]-[#8]-[#6:8](=[#8:9])-[#6:10]
EVODEX.1-Em3 - Reaction Operator Em
[#6]-[#7](-[H])-[#6:42](-[#6:40])=[#8:43]>>[H]-[#8]-[#6:42](-[#6:40])=[#8:43]
EVODEX.1-Nm3 - Reaction Operator Nm
[#6]-[#7](-[H])-[#6:42](-[#6:40])=[#8:43]>>[H]-[#8]-[#6:42](-[#6:40])=[#8:43]
Source Full Reactions
EVODEX.1-R5593
[N:1]([C:2]([C:3]([C:4]([C:5]([C@:6]([N:7]([C:8](=[O:9])[C:10]([C:11]([C:12]([N:13]([H:18])[H:19])([H:20])[H:21])([H:22])[H:23])([H:24])[H:25])[H:26])([C:14](=[O:15])[O:16][H:27])[H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38].[H][O:17][H:39]>>[C:8](=[O:9])([C:10]([C:11]([C:12]([N:13]([H:18])[H:19])([H:20])[H:21])([H:22])[H:23])([H:24])[H:25])[O:17][H:39].[H][N:7]([C@@:6]([C:5]([C:4]([C:3]([C:2]([N:1]([H:37])[H:38])([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([C:14](=[O:15])[O:16][H:27])[H:28])[H:26]