EVODEX.1-P774

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:6]([C:5](=[C:4]([C:3]([C:2]([C:1]([H:18])([H:19])[H:20])([H:16])[H:17])([H:14])[H:15])[H:13])[H:12])=[O:7].[O:9]=[O:10].[H][O:8][H:21]>>[C:1]([C:2]([C:3]([C:4](=[C:5]([C:6](=[O:7])[O:8][H:21])[H:12])[H:13])([H:14])[H:15])([H:16])[H:17])([H:18])([H:19])[H:20].[H][O:9][O:10][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

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-Em313 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:5](-[#6:3]=[#6:2])=[#8:6].[#8:8]=[#8:9].[H]-[#8:7]>>[#6:2]=[#6:3]-[#6:5](=[#8:6])-[#8:7].[H]-[#8:8]-[#8:9]-[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-R738

Full Reaction Rendering

[H][C:6]([C:5](=[C:4]([C:3]([C:2]([C:1]([H:18])([H:19])[H:20])([H:16])[H:17])([H:14])[H:15])[H:13])[H:12])=[O:7].[O:9]=[O:10].[H][O:8][H:21]>>[C:1]([C:2]([C:3]([C:4](=[C:5]([C:6](=[O:7])[O:8][H:21])[H:12])[H:13])([H:14])[H:15])([H:16])[H:17])([H:18])([H:19])[H:20].[H][O:9][O:10][H]