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EVODEX.1-P5875

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[N:1](=[C:2]([N:3]([H:14])[H:15])[N:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27])[H:28]>>[H][N:1]([C:2](=O)[N:3]([H:14])[H:15])[H:28].[H][N:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27]

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E363 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1](=[#6:2](-[#7:3])-[#7:12](-[#6@@:13])-[H:83])-[H:84]>>[#7:12](-[#6@@:13])(-[H:83])-[H].[#7:1](-[#6:2](-[#7:3])=[#8])(-[H:84])-[H]

EVODEX.1-C1137 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:1]=[#6:2]-[#7:4]>>[H]-[#7:1]-[#6:2]=[#8].[H]-[#7:4]

EVODEX.1-N1158 - Reaction Operator N

Reaction Operator N SMIRKS

nan

EVODEX.1-Em652 - Reaction Operator Em

Reaction Operator Em SMIRKS

nan

EVODEX.1-Cm329 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:1]=[#6:2]-[#7:4]>>[H]-[#7:1]-[#6:2]=[#8].[H]-[#7:4]

EVODEX.1-Nm585 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

nan

Source Full Reactions

EVODEX.1-R6552

Full Reaction Rendering

[N:1](=[C:2]([N:3]([H:14])[H:15])[N:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27])[H:28].[H][O:13][H]>>[H][N:1]([C:2]([N:3]([H:14])[H:15])=[O:13])[H:28].[H][N:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:16])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27]