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EVODEX.1-P4613

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OC([H])([H])[C@@]([H])(C(=O)[N:7]([C:8]([C:9](=[O:10])[N:11]([C:12]([C:13](=[O:14])[O:15][H:20])([H:21])[H:22])[H:23])([H:24])[H:25])[H:26])N([H])[H]>>[H][N:7]([C:8]([C:9](=[O:10])[N:11]([C:12]([C:13](=[O:14])[O:15][H:20])([H:21])[H:22])[H:23])([H:24])[H:25])[H:26]

Derived Operators

EVODEX.1-F264 - Elemental Balance

O-2
C-3
N-1
H-5

EVODEX.1-M77 - Mass Difference

-87.03205000000001

EVODEX.1-E999 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:18](-[#6@:13])(-[#6](=[#8])-[#6@@](-[#7](-[H])-[H])(-[#6](-[#8]-[H])(-[H])-[H])-[H])-[H:47]>>[#7:18](-[#6@:13])(-[H:47])-[H]

EVODEX.1-C557 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8]-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:13])-[#7](-[H])-[H]>>[H]-[#7:13]

EVODEX.1-N710 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8]-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:13](-[#6@:4])-[H:34])-[#7](-[H])-[H]>>[H]-[#7:13](-[#6@:4])-[H:34]

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-R5438

Full Reaction Rendering

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