SMIRKS
[H]OC(=O)C(=O)C([H])([H])[C:8](=[O:9])[C:10]1:[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]([H:20]):[C:15]:1[H:21]>>[H]O[C:8](=[O:9])[C:10]1:[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]([H:20]):[C:15]:1[H:21]
Derived Operators
EVODEX.1-F38 - Elemental Balance
| C | -3 |
| O | -2 |
| H | -2 |
EVODEX.1-M98 - Mass Difference
-70.00546
EVODEX.1-E513 - Reaction Operator E
[#6:4](-[#6@:2])(=[#8:5])-[#6](-[#6](=[#8])-[#6](=[#8])-[#8]-[H])(-[H])-[H]>>[#6:4](-[#6@:2])(=[#8:5])-[#8]-[H]
EVODEX.1-C723 - Reaction Operator C
[H]-[#8]-[#6](=[#8])-[#6](=[#8])-[#6](-[H])(-[H])-[#6:8]>>[H]-[#8]-[#6:8]
EVODEX.1-N891 - Reaction Operator N
[H]-[#8]-[#6](=[#8])-[#6](=[#8])-[#6](-[H])(-[H])-[#6:8](=[#8:9])-[#6:10]>>[H]-[#8]-[#6:8](=[#8:9])-[#6:10]
EVODEX.1-Em136 - Reaction Operator Em
[#6]-[#6](-[H])(-[H])-[#6:9](-[#6:8])=[#8:10]>>[H]-[#8]-[#6:9](-[#6:8])=[#8:10]
EVODEX.1-Nm166 - Reaction Operator Nm
[#6]-[#6](-[H])(-[H])-[#6:9](-[#6:8])=[#8:10]>>[H]-[#8]-[#6:9](-[#6:8])=[#8:10]
Source Full Reactions
EVODEX.1-R6668
[O:2]=[C:3]([O:4][H:16])[C:5](=[O:6])[C:7]([C:8](=[O:9])[C:10]1:[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]([H:20]):[C:15]:1[H:21])([H:22])[H:23].[H][O:1][H:24]>>[H][C:7]([C:5]([C:3](=[O:2])[O:4][H:16])=[O:6])([H:22])[H:23].[O:1]([C:8](=[O:9])[C:10]1:[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]([H:20]):[C:15]:1[H:21])[H:24]