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EVODEX.1-P929

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OC(=O)C([H])([H])C([H])(C(=O)O[H])[N:4]([C:2]([C:1]([H:22])([H:23])[H:24])=[O:3])[H:21]>>[H][N:4]([C:2]([C:1]([H:22])([H:23])[H:24])=[O:3])[H:21]

Derived Operators

EVODEX.1-F250 - Elemental Balance

O-4
C-4
H-4

EVODEX.1-M305 - Mass Difference

-116.01092

EVODEX.1-E974 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C243 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N230 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em83 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm1 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm112 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R914

Full Reaction Rendering

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