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EVODEX.1-P132

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:12]=[O:13].[H][C:8]([C:7]1:[C:6]([H:16]):[C:5]([H:15]):[C:4]([C:2](=[O:1])[O:3][H:14]):[O:11]:1)([O:9][H])[O:10][H:18]>>[O:1]=[C:2]([O:3][H:14])[C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([C:8](=[O:9])[O:10][H:18]):[O:11]:1.[H][O:12][O:13][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E196 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:1]=[#8:2].[#8:10]-[#6:11](-[#8:12]-[H])(-[H])-[#6@@:13]>>[#8:10]-[#6:11](=[#8:12])-[#6@@:13].[#8:1](-[#8:2]-[H])-[H]

EVODEX.1-C40 - Reaction Operator C

Reaction Operator C SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-N1191 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6@:11]>>[#8:3]=[#6:4](-[#8:5])-[#6@:11].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Em183 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Cm63 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Nm190 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]

Source Full Reactions

EVODEX.1-R173

Full Reaction Rendering

[O:12]=[O:13].[H][C:8]([C:7]1:[C:6]([H:16]):[C:5]([H:15]):[C:4]([C:2](=[O:1])[O:3][H:14]):[O:11]:1)([O:9][H])[O:10][H:18]>>[O:1]=[C:2]([O:3][H:14])[C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([C:8](=[O:9])[O:10][H:18]):[O:11]:1.[H][O:12][O:13][H]