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EVODEX.1-P4627

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C@]([H])(C(=O)[N:6]([C@@:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:19])([H:20])[H:21])([H:22])[H:23])([C:13](=[O:14])[O:15][H:24])[H:25])[H:26])C([H])([H])[H]>>[H][N:6]([C@@:7]([C:8]([C:9]([C:10](=[O:11])[O:12][H:19])([H:20])[H:21])([H:22])[H:23])([C:13](=[O:14])[O:15][H:24])[H:25])[H:26]

Derived Operators

EVODEX.1-F138 - Elemental Balance

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

EVODEX.1-M45 - Mass Difference

-71.03715000000001

EVODEX.1-E790 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:18](-[#6@:13])(-[#6](=[#8])-[#6@](-[#6](-[H])(-[H])-[H])(-[#7](-[H])-[H])-[H])-[H:46]>>[#7:18](-[#6@:13])(-[H:46])-[H]

EVODEX.1-C546 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N697 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6@](-[H])(-[#6](=[#8])-[#7:6](-[#6@@:7])-[H:23])-[#6](-[H])(-[H])-[H]>>[H]-[#7:6](-[#6@@:7])-[H:23]

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-R5451

Full Reaction Rendering

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