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EVODEX.1-P4645

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C@]([H])(C(=O)[N:8]([C@@:9]([C:10]([H:20])([H:21])[H:22])([C:11](=[O:12])[O:13][H:23])[H:24])[H:25])C([H])(C([H])([H])[H])C([H])([H])[H]>>[H][N:8]([C@@:9]([C:10]([H:20])([H:21])[H:22])([C:11](=[O:12])[O:13][H:23])[H:24])[H:25]

Derived Operators

EVODEX.1-F257 - Elemental Balance

O-1
C-5
N-1
H-9

EVODEX.1-M179 - Mass Difference

-99.06847

EVODEX.1-E971 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#6](-[#6](-[H])(-[H])-[H])(-[#6@](-[#7](-[H])-[H])(-[#6](=[#8])-[#7:8](-[#6@@:9])-[H:36])-[H])-[H])(-[H])(-[H])-[H]>>[#7:8](-[#6@@:9])(-[H:36])-[H]

EVODEX.1-C511 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N643 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:8](-[#6@@:9])-[H:51])-[#6](-[H])(-[#6](-[H])(-[H])-[H])-[#6](-[H])(-[H])-[H]>>[H]-[#7:8](-[#6@@:9])-[H:51]

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-R5468

Full Reaction Rendering

[C:1]([C:2]([C:3]([H:15])([H:16])[H:17])([C@:4]([N:5]([H:18])[H:19])([C:6](=[O:7])[N:8]([C@@:9]([C:10]([H:20])([H:21])[H:22])([C:11](=[O:12])[O:13][H:23])[H:24])[H:25])[H:26])[H:27])([H:28])([H:29])[H:30].[H][O:14][H:31]>>[C:1]([C:2]([C:3]([H:15])([H:16])[H:17])([C@:4]([N:5]([H:18])[H:19])([C:6](=[O:7])[O:14][H:31])[H:26])[H:27])([H:28])([H:29])[H:30].[H][N:8]([C@@:9]([C:10]([H:20])([H:21])[H:22])([C:11](=[O:12])[O:13][H:23])[H:24])[H:25]