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EVODEX.1-P5568

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E373 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10](-[#8:11])-[H:63]>>[#7:10](-[#8:11])(-[H:63])-[H].[#6:7]-[#6:8](=[#8:9])-[#8]-[H]

EVODEX.1-C23 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[H]-[#8]-[#6:5]

EVODEX.1-N1151 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#8:5])-[H:8]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4](-[#8:5])-[H:8]

EVODEX.1-Em662 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4]-[#8:5]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4]-[#8:5]

EVODEX.1-Cm18 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[#8]-[#6:5]

EVODEX.1-Nm595 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4]-[#8:5]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4]-[#8:5]

Source Full Reactions

EVODEX.1-R6304

Full Reaction Rendering

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