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EVODEX.1-P5681

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F33 - Elemental Balance

O-1
H-2

EVODEX.1-M4 - Mass Difference

-18.010559999999998

EVODEX.1-E485 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1](-[H:71])(-[H:72])-[H].[#8:33]=[#6:34](-[#8]-[H])-[#6:36]>>[#7:1](-[#6:34](=[#8:33])-[#6:36])(-[H:71])-[H:72]

EVODEX.1-C16 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7:1].[H]-[#8]-[#6:16]>>[#7:1]-[#6:16]

EVODEX.1-N863 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:1](-[H:11])-[H:12].[H]-[#8]-[#6:3](=[#8:2])-[#6:5]>>[#7:1](-[#6:3](=[#8:2])-[#6:5])(-[H:11])-[H:12]

EVODEX.1-Em671 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:1].[H]-[#8]-[#6:3](=[#8:2])-[#6:5]>>[#7:1]-[#6:3](=[#8:2])-[#6:5]

EVODEX.1-Cm19 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#8]-[#6:42].[H]-[#7:47]>>[#6:42]-[#7:47]

EVODEX.1-Nm604 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:1].[H]-[#8]-[#6:3](=[#8:2])-[#6:5]>>[#7:1]-[#6:3](=[#8:2])-[#6:5]

Source Full Reactions

EVODEX.1-R6396

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