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EVODEX.1-P1065

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-E43 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]-[#6:4](-[#7:5](-[H:10])-[H:11])(-[H:12])-[H].[#8:6](-[H])-[H]>>[#6:2]-[#6:4](=[#8:6])-[H:12].[#7:5](-[H:10])(-[H:11])-[H]

EVODEX.1-C19 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:1]-[#7:2].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]

EVODEX.1-N237 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:7](-[#6:6])(-[#7:8](-[H:16])-[H:17])-[H:18].[H]-[#8:10]-[H]>>[#6:6]-[#6:7](=[#8:10])-[H:18].[H]-[#7:8](-[H:16])-[H:17]

EVODEX.1-Em352 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm56 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:1]-[#7:2].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]

EVODEX.1-Nm319 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R1015

Full Reaction Rendering

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