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EVODEX.1-P5550

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C([H])(Cl)C(=O)[N:8]([C@@:7]([C:6]([C:5]([C:3](=[O:2])[O:4][H:16])([H:24])[H:25])([H:22])[H:23])([C:13](=[O:14])[O:15][H:20])[H:21])[H:19]>>[H][N:8]([C@@:7]([C:6]([C:5]([C:3](=[O:2])[O:4][H:16])([H:24])[H:25])([H:22])[H:23])([C:13](=[O:14])[O:15][H:20])[H:21])[H:19]

Derived Operators

EVODEX.1-F496 - Elemental Balance

Cl-1
O-1
C-2
H-1

EVODEX.1-M470 - Mass Difference

-75.97162999999999

EVODEX.1-E1315 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:5]-[#7:6](-[#6](=[#8])-[#6](-[#17])(-[H])-[H])-[H:17]>>[#6:5]-[#7:6](-[H:17])-[H]

EVODEX.1-C600 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6](-[H])(-[#17])-[#6](=[#8])-[#7:6]>>[H]-[#7:6]

EVODEX.1-N757 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6](-[H])(-[#17])-[#6](=[#8])-[#7:6](-[#6:5])-[H:17]>>[H]-[#7:6](-[#6:5])-[H:17]

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-R6288

Full Reaction Rendering

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