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EVODEX.1-P661

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:7]1:[N:6]:[C:5]2:[C:3](=[O:4]):[N:2]([C:1]([H:22])([H:23])[H:24]):[C:12](=[O:13]):[N:10]([C:11]([H:19])([H:20])[H:21]):[C:9]:2:[N:8]:1[H:18]>>[H]O[C:7]1:[N:6]:[C:5]2:[C:3](=[O:4]):[N:2]([C:1]([H:22])([H:23])[H:24]):[C:12](=[O:13]):[N:10]([C:11]([H:19])([H:20])[H:21]):[C:9]:2:[N:8]:1[H:18]

Derived Operators

EVODEX.1-F10 - Elemental Balance

O1

EVODEX.1-M6 - Mass Difference

15.9949

EVODEX.1-E410 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C4 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:5]>>[H]-[#8]-[#6:5]

EVODEX.1-N204 - Reaction Operator N

Reaction Operator N SMIRKS

nan

EVODEX.1-Em292 - Reaction Operator Em

Reaction Operator Em SMIRKS

nan

EVODEX.1-Cm32 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:5]>>[#8]-[#6:5]

EVODEX.1-Nm290 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

nan

Source Full Reactions

EVODEX.1-R614

Full Reaction Rendering

[H][C:7]1:[N:6]:[C:5]2:[C:3](=[O:4]):[N:2]([C:1]([H:22])([H:23])[H:24]):[C:12](=[O:13]):[N:10]([C:11]([H:19])([H:20])[H:21]):[C:9]:2:[N:8]:1[H:18].[O:15]=[O:16].[H][O:14][H:25]>>[C:1]([N:2]1:[C:3](=[O:4]):[C:5]2:[N:6]:[C:7]([O:14][H:25]):[N:8]([H:18]):[C:9]:2:[N:10]([C:11]([H:19])([H:20])[H:21]):[C:12]:1=[O:13])([H:22])([H:23])[H:24].[H][O:15][O:16][H]