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EVODEX.1-P775

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E153 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:5]-[#6:6](=[#8:7])-[H].[#8:15]=[#8:16].[#8:14](-[H:27])-[H]>>[#6:5]-[#6:6](=[#8:7])-[#8:14]-[H:27].[#8:15](-[#8:16]-[H])-[H]

EVODEX.1-C100 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:5].[#8:8]=[#8:9].[H]-[#8:7]>>[#6:5]-[#8:7].[H]-[#8:8]-[#8:9]-[H]

EVODEX.1-N30 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:5](-[#6:3])=[#8:6].[#8:8]=[#8:9].[H]-[#8:7]-[H:18]>>[#6:3]-[#6:5](=[#8:6])-[#8:7]-[H:18].[H]-[#8:8]-[#8:9]-[H]

EVODEX.1-Em293 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:3](=[#8:2])-[#6:4].[#8:9]=[#8:10].[H]-[#8:1]>>[#8:1]-[#6:3](=[#8:2])-[#6:4].[H]-[#8:9]-[#8:10]-[H]

EVODEX.1-Cm122 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:5].[#8:8]=[#8:9].[H]-[#8:7]>>[#6:5]-[#8:7].[H]-[#8:8]-[#8:9]-[H]

EVODEX.1-Nm101 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:5](-[#6:3])=[#8:6].[#8:8]=[#8:9].[H]-[#8:7]>>[#6:3]-[#6:5](=[#8:6])-[#8:7].[H]-[#8:8]-[#8:9]-[H]

Source Full Reactions

EVODEX.1-R740

Full Reaction Rendering

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