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EVODEX.1-P659

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:8]1:[N:7]:[C:6]2:[N:5]:[C:4]([H:14]):[N:3]:[C:2]([N:1]([H:17])[H:18]):[C:10]:2:[N:9]:1[H:16].[H][O:11][H:19]>>[N:1]([C:2]1:[N:3]:[C:4]([H:14]):[N:5]:[C:6]2:[N:7]:[C:8]([O:11][H:19]):[N:9]([H:16]):[C:10]:1:2)([H:17])[H:18]

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-E45 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1]#[#6:2]-[#7:3].[#8:4](-[H])-[H]>>[#7:1](-[#6:2](-[#7:3])=[#8:4])(-[H])-[H]

EVODEX.1-C71 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:5].[H]-[#8:7]>>[#6:5]-[#8:7]

EVODEX.1-N203 - Reaction Operator N

Reaction Operator N SMIRKS

[#7:1]#[#6:2]-[#7:3].[H]-[#8:4]-[H]>>[H]-[#7:1](-[H])-[#6:2](-[#7:3])=[#8:4]

EVODEX.1-Em291 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#7:1]#[#6:2]-[#7:3].[H]-[#8:4]-[H]>>[H]-[#7:1](-[H])-[#6:2](-[#7:3])=[#8:4]

EVODEX.1-Cm112 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:5].[H]-[#8:7]>>[#6:5]-[#8:7]

EVODEX.1-Nm289 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#7:1]#[#6:2]-[#7:3].[H]-[#8:4]-[H]>>[H]-[#7:1](-[H])-[#6:2](-[#7:3])=[#8:4]

Source Full Reactions

EVODEX.1-R612

Full Reaction Rendering

[H][C:8]1:[N:7]:[C:6]2:[N:5]:[C:4]([H:14]):[N:3]:[C:2]([N:1]([H:17])[H:18]):[C:10]:2:[N:9]:1[H:16].[O:12]=[O:13].[H][O:11][H:19]>>[N:1]([C:2]1:[N:3]:[C:4]([H:14]):[N:5]:[C:6]2:[N:7]:[C:8]([O:11][H:19]):[N:9]([H:16]):[C:10]:1:2)([H:17])[H:18].[H][O:12][O:13][H]