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EVODEX.1-P5816

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[H]C([H])([H])C([H])([H])C(=O)[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]

Derived Operators

EVODEX.1-F109 - Elemental Balance

O1
C3
H4

EVODEX.1-M238 - Mass Difference

56.02622

EVODEX.1-E693 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:6](-[#6:7])(-[H:27])-[H]>>[#6](-[#6](-[#6](=[#8])-[#7:6](-[#6:7])-[H:27])(-[H])-[H])(-[H])(-[H])-[H]

EVODEX.1-C302 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N345 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:6](-[#6:7])-[H:27]>>[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7:6](-[#6:7])-[H:27]

EVODEX.1-Em4 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm5 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm4 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6507

Full Reaction Rendering

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