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EVODEX.1-P5783

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F36 - Elemental Balance

O1
C1

EVODEX.1-M205 - Mass Difference

27.9949

EVODEX.1-E507 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1](-[#6:2])(-[H:19])-[H]>>[#7:1](-[#6:2])(-[#6](=[#8])-[H])-[H:19]

EVODEX.1-C261 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N285 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:6](-[#6@:5])-[H:16]>>[H]-[#6](=[#8])-[#7:6](-[#6@:5])-[H:16]

EVODEX.1-Em408 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm5 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm368 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6479

Full Reaction Rendering

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