SMIRKS
[H][N:11]([C:12]([C:13]([C:14]([C:15]([N:16]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27].[H]N([H])[C:2](=[O:3])[C:4]([C:5]([C@:6]([N:7]([H:29])[H:30])([C:8](=[O:9])[O:10][H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[C:2](=[O:3])([C:4]([C:5]([C@:6]([N:7]([H:29])[H:30])([C:8](=[O:9])[O:10][H:31])[H:32])([H:33])[H:34])([H:35])[H:36])[N:11]([C:12]([C:13]([C:14]([C:15]([N:16]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27]
Derived Operators
EVODEX.1-F73 - Elemental Balance
| N | -1 |
| H | -3 |
EVODEX.1-M12 - Mass Difference
-17.02659
EVODEX.1-E631 - Reaction Operator E
[#7:11](-[#6@@:12])(-[H:33])-[H].[#7](-[#6:2](=[#8:3])-[#6:4])(-[H])-[H]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11](-[#6@@:12])-[H:33]
EVODEX.1-N421 - Reaction Operator N
[H]-[#7:11](-[#6@@:12])-[H:32].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11](-[#6@@:12])-[H:32]
EVODEX.1-Em467 - Reaction Operator Em
[H]-[#7:11]-[#6:12].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11]-[#6:12]
EVODEX.1-Nm418 - Reaction Operator Nm
[H]-[#7:11]-[#6:12].[H]-[#7](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#6:2](=[#8:3])(-[#6:4])-[#7:11]-[#6:12]
Source Full Reactions
EVODEX.1-R2870
[H][N:11]([C:12]([C:13]([C:14]([C:15]([N:16]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27].[N:1]([C:2](=[O:3])[C:4]([C:5]([C@:6]([N:7]([H:29])[H:30])([C:8](=[O:9])[O:10][H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38]>>[C:2](=[O:3])([C:4]([C:5]([C@:6]([N:7]([H:29])[H:30])([C:8](=[O:9])[O:10][H:31])[H:32])([H:33])[H:34])([H:35])[H:36])[N:11]([C:12]([C:13]([C:14]([C:15]([N:16]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27].[H][N:1]([H:37])[H:38]