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EVODEX.1-P779

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:5]([C:4](=[C:3]([C:2]([C:1]([H:15])([H:16])[H:17])([H:13])[H:14])[H:12])[H:11])=[O:6].[H][O:7][H:18]>>[C:1]([C:2]([C:3](=[C:4]([C:5](=[O:6])[O:7][H:18])[H:11])[H:12])([H:13])[H:14])([H:15])([H:16])[H:17]

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-C71 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N27 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em304 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:5](-[#6:4]=[#6:3])=[#8:6].[H]-[#8:7]>>[#6:3]=[#6:4]-[#6:5](=[#8:6])-[#8:7]

EVODEX.1-Cm112 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm92 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R743

Full Reaction Rendering

[H][C:5]([C:4](=[C:3]([C:2]([C:1]([H:15])([H:16])[H:17])([H:13])[H:14])[H:12])[H:11])=[O:6].[O:8]=[O:9].[H][O:7][H:18]>>[C:1]([C:2]([C:3](=[C:4]([C:5](=[O:6])[O:7][H:18])[H:11])[H:12])([H:13])[H:14])([H:15])([H:16])[H:17].[H][O:8][O:9][H]