SMIRKS
[H]O[C:7]([C:6]([C:5]([N:4]([C:2]([N:1]([H])[H:26])=[O:3])[H:25])([C:10]1:[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]([H:22]):[C:15]:1[H:23])[H:24])([H:17])[H:18])=[O:8]>>[N:1]1([H:26])[C:2](=[O:3])[N:4]([H:25])[C:5]([C:10]2:[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]([H:22]):[C:15]:2[H:23])([H:24])[C:6]([H:17])([H:18])[C:7]1=[O:8]
Derived Operators
EVODEX.1-F33 - Elemental Balance
| O | -1 |
| H | -2 |
EVODEX.1-M4 - Mass Difference
-18.010559999999998
EVODEX.1-E479 - Reaction Operator E
([#7:1](-[#6@:2])(-[H:18])-[H].[#6:4]-[#6:5](=[#8:6])-[#8]-[H])>>[#7:1](-[H:18])(-[#6@:2])-[#6:5](-[#6:4])=[#8:6]
EVODEX.1-N1273 - Reaction Operator N
([H]-[#8]-[#6:7](-[#6:6])=[#8:8].[#6:2]-[#7:1](-[H])-[H:26])>>[#7:1](-[H:26])(-[#6:2])-[#6:7](-[#6:6])=[#8:8]
EVODEX.1-Em476 - Reaction Operator Em
([H]-[#8]-[#6:7](-[#6:6])=[#8:8].[#6:2]-[#7:1]-[H])>>[#7:1](-[#6:2])-[#6:7](-[#6:6])=[#8:8]
EVODEX.1-Nm427 - Reaction Operator Nm
([H]-[#8]-[#6:7](-[#6:6])=[#8:8].[#6:2]-[#7:1]-[H])>>[#7:1](-[#6:2])-[#6:7](-[#6:6])=[#8:8]
Source Full Reactions
EVODEX.1-R6534
[H][N:1]([C:2](=[O:3])[N:4]([C:5]([C:6]([C:7](=[O:8])[O:9][H:16])([H:17])[H:18])([C:10]1:[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]([H:22]):[C:15]:1[H:23])[H:24])[H:25])[H:26]>>[N:1]1([H:26])[C:2](=[O:3])[N:4]([H:25])[C:5]([C:10]2:[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]([H:22]):[C:15]:2[H:23])([H:24])[C:6]([H:17])([H:18])[C:7]1=[O:8].[H][O:9][H:16]