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EVODEX.1-P5563

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:1]([H:11])[H:12].[O:2]=[C:3]([O:4][H:14])[C:5]1:[C:6]([H:15]):[C:7]([H:16]):[C:8]([H:17]):[N:9]:[C:10]:1[H:18]>>[N:1]([C:3](=[O:2])[C:5]1:[C:6]([H:15]):[C:7]([H:16]):[C:8]([H:17]):[N:9]:[C:10]:1[H:18])([H:11])[H:12].[H][O:4][H:14]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E102 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:4]-[#6:5](=[#8:6])-[#8:7]-[H:8].[#7:1](-[H:11])(-[H:12])-[H]>>[#7:1](-[#6:5](-[#6:4])=[#8:6])(-[H:11])-[H:12].[#8:7](-[H:8])-[H]

EVODEX.1-C10 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:2]-[#8:4].[H]-[#7:19]>>[#6:2]-[#7:19].[H]-[#8:4]

EVODEX.1-N808 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:6]-[#6:7](=[#8:8])-[#8:9]-[H:14].[H]-[#7:1](-[H:19])-[H:20]>>[#7:1](-[#6:7](-[#6:6])=[#8:8])(-[H:19])-[H:20].[H]-[#8:9]-[H:14]

EVODEX.1-Em655 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:6]-[#6:7](=[#8:8])-[#8:9].[H]-[#7:1]>>[#7:1]-[#6:7](-[#6:6])=[#8:8].[H]-[#8:9]

EVODEX.1-Cm34 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:2]-[#8:4].[H]-[#7:19]>>[#6:2]-[#7:19].[H]-[#8:4]

EVODEX.1-Nm588 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:6]-[#6:7](=[#8:8])-[#8:9].[H]-[#7:1]>>[#7:1]-[#6:7](-[#6:6])=[#8:8].[H]-[#8:9]

Source Full Reactions

EVODEX.1-R6299

Full Reaction Rendering

[H][N:1]([H:11])[H:12].[O:2]=[C:3]([O:4][H:14])[C:5]1:[C:6]([H:15]):[C:7]([H:16]):[C:8]([H:17]):[N:9]:[C:10]:1[H:18]>>[N:1]([C:3](=[O:2])[C:5]1:[C:6]([H:15]):[C:7]([H:16]):[C:8]([H:17]):[N:9]:[C:10]:1[H:18])([H:11])[H:12].[H][O:4][H:14]