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EVODEX.1-P4618

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F275 - Elemental Balance

C-2
O-1
N-1
H-3

EVODEX.1-M564 - Mass Difference

-57.02149000000001

EVODEX.1-E992 - Reaction Operator E

Reaction Operator E SMIRKS

[#7](-[#6](-[#6](=[#8])-[#7:5](-[#6@:6])-[H:78])(-[H])-[H])(-[H])-[H]>>[#7:5](-[#6@:6])(-[H:78])-[H]

EVODEX.1-C133 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7](-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7:22]>>[H]-[#7:22]

EVODEX.1-N705 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7:22](-[#6:21])-[H:47]>>[H]-[#7:22](-[#6:21])-[H:47]

EVODEX.1-Em1 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm1 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#7:7]>>[H]-[#7:7]

EVODEX.1-Nm1 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R5442

Full Reaction Rendering

[N:1]([C:2]([C:3](=[O:4])[N:5]([C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]2:[C:10]([H:19]):[C:11]([H:20]):[C:12]([H:21]):[C:13]([H:22]):[C:14]:2:[C:15]:1[H:23])[H:24])([H:25])[H:26])([H:27])[H:28].[H][O:16][H:29]>>[N:1]([C:2]([C:3](=[O:4])[O:16][H:29])([H:25])[H:26])([H:27])[H:28].[H][N:5]([C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]2:[C:10]([H:19]):[C:11]([H:20]):[C:12]([H:21]):[C:13]([H:22]):[C:14]:2:[C:15]:1[H:23])[H:24]