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EVODEX.1-P5840

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]O[C:7]([C@:2]([C:1]([H:15])([H:16])[H:17])([N:3]([C:4]([N:5]([H])[H:10])=[O:6])[H:12])[H:14])=[O:8]>>[C:1]([C@:2]1([H:14])[N:3]([H:12])[C:4](=[O:6])[N:5]([H:10])[C:7]1=[O:8])([H:15])([H:16])[H:17]

Derived Operators

EVODEX.1-F33 - Elemental Balance

O-1
H-2

EVODEX.1-M4 - Mass Difference

-18.010559999999998

EVODEX.1-E479 - Reaction Operator E

Reaction Operator E SMIRKS

([#7:1](-[#6@:2])(-[H:18])-[H].[#6:4]-[#6:5](=[#8:6])-[#8]-[H])>>[#7:1](-[H:18])(-[#6@:2])-[#6:5](-[#6:4])=[#8:6]

EVODEX.1-C1018 - Reaction Operator C

Reaction Operator C SMIRKS

([H]-[#8]-[#6:7].[#7:1]-[H])>>[#7:1]-[#6:7]

EVODEX.1-N1273 - Reaction Operator N

Reaction Operator N SMIRKS

([H]-[#8]-[#6:7](-[#6:6])=[#8:8].[#6:2]-[#7:1](-[H])-[H:26])>>[#7:1](-[H:26])(-[#6:2])-[#6:7](-[#6:6])=[#8:8]

EVODEX.1-Em476 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm239 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

([#8]-[#6:7].[#7:1]-[H])>>[#7:1]-[#6:7]

EVODEX.1-Nm427 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6529

Full Reaction Rendering

[H][N:5]([C:4]([N:3]([C@@:2]([C:1]([H:15])([H:16])[H:17])([C:7](=[O:8])[O:9][H:13])[H:14])[H:12])=[O:6])[H:10]>>[C:1]([C@:2]1([H:14])[N:3]([H:12])[C:4](=[O:6])[N:5]([H:10])[C:7]1=[O:8])([H:15])([H:16])[H:17].[H][O:9][H:13]