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EVODEX.1-P4647

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])[C:2](=[O:3])[C@@:4]([N:5]([H:9])[H:10])([C:6]([O:7][H:11])([H:12])[H:13])[H:14].[H][O:8][H:17]>>[C:2](=[O:3])([C@@:4]([N:5]([H:9])[H:10])([C:6]([O:7][H:11])([H:12])[H:13])[H:14])[O:8][H:17]

Derived Operators

EVODEX.1-F73 - Elemental Balance

N-1
H-3

EVODEX.1-M12 - Mass Difference

-17.02659

EVODEX.1-E626 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:6]-[#6:7](-[#7](-[H])-[H])=[#8:9].[#8:10](-[H:21])-[H]>>[#6:6]-[#6:7](=[#8:9])-[#8:10]-[H:21]

EVODEX.1-C904 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7](-[H])-[#6:21].[H]-[#8:24]>>[#6:21]-[#8:24]

EVODEX.1-N1137 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6:21](-[#6@:5])=[#8:23].[H]-[#8:24]-[H:48]>>[#6:21](-[#6@:5])(=[#8:23])-[#8:24]-[H:48]

EVODEX.1-Em641 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7](-[H])-[#6:8](-[#6:7])=[#8:10].[H]-[#8:14]>>[#6:7]-[#6:8](=[#8:10])-[#8:14]

EVODEX.1-Cm3 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]-[#6:4].[H]-[#8:13]>>[#6:4]-[#8:13]

EVODEX.1-Nm576 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7](-[H])-[#6:8](-[#6:7])=[#8:10].[H]-[#8:14]>>[#6:7]-[#6:8](=[#8:10])-[#8:14]

Source Full Reactions

EVODEX.1-R5469

Full Reaction Rendering

[N:1]([C:2](=[O:3])[C@@:4]([N:5]([H:9])[H:10])([C:6]([O:7][H:11])([H:12])[H:13])[H:14])([H:15])[H:16].[H][O:8][H:17]>>[C:2](=[O:3])([C@@:4]([N:5]([H:9])[H:10])([C:6]([O:7][H:11])([H:12])[H:13])[H:14])[O:8][H:17].[H][N:1]([H:15])[H:16]