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EVODEX.1-P5780

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E253 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#8:4]-[H:14].[#6:8]-[#6@@:9](-[#7:10](-[H:18])-[H])(-[#6:11])-[H:21]>>[#6:1]-[#6:2](=[#8:3])-[#7:10](-[#6@:9](-[#6:8])(-[#6:11])-[H:21])-[H:18].[#8:4](-[H:14])-[H]

EVODEX.1-C913 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:2]-[#8:4].[H]-[#7:9]-[#6@:8]>>[#6:2]-[#7:9]-[#6:8].[H]-[#8:4]

EVODEX.1-N1270 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#8:4]-[H:13].[H]-[#7:9](-[#6@:8](-[#6:6])(-[#6:10])-[H:23])-[H:20]>>[#6:1]-[#6:2](=[#8:3])-[#7:9](-[#6:8](-[#6:6])(-[#6:10])-[H:23])-[H:20].[H]-[#8:4]-[H:13]

EVODEX.1-Em54 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#8:4].[H]-[#7:19]-[#6:18]>>[#6:1]-[#6:2](=[#8:3])-[#7:19]-[#6:18].[H]-[#8:4]

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-Nm61 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#8:4].[H]-[#7:19]-[#6:18]>>[#6:1]-[#6:2](=[#8:3])-[#7:19]-[#6:18].[H]-[#8:4]

Source Full Reactions

EVODEX.1-R6476

Full Reaction Rendering

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