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EVODEX.1-P6184

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][O:11][C:9]([C:7]([C:6]1:[C:5]([H:15]):[C:4]([H:14]):[C:3]([C:2]([C:1]([H:21])([H:22])[H:23])([H:19])[H:20]):[C:13]([H:18]):[C:12]:1[H:17])=[O:8])=[O:10]>>[C:9](=[O:10])=[O:11].[H][C:7]([C:6]1:[C:5]([H:15]):[C:4]([H:14]):[C:3]([C:2]([C:1]([H:21])([H:22])[H:23])([H:19])[H:20]):[C:13]([H:18]):[C:12]:1[H:17])=[O:8]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E161 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:1]=[#6:2](-[#8:3]-[H])-[#6:4](=[#8:5])-[#6:6]>>[#6:4](=[#8:5])(-[#6:6])-[H].[#8:1]=[#6:2]=[#8:3]

EVODEX.1-C3 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N299 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8:12]-[#6:10](-[#6:8](-[#6:7])=[#8:9])=[#8:11]>>[#6:10](=[#8:11])=[#8:12].[H]-[#6:8](-[#6:7])=[#8:9]

EVODEX.1-Em421 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#8:12]-[#6:10](-[#6:8](-[#6:7])=[#8:9])=[#8:11]>>[#6:10](=[#8:11])=[#8:12].[H]-[#6:8](-[#6:7])=[#8:9]

EVODEX.1-Cm26 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm381 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#8:12]-[#6:10](-[#6:8](-[#6:7])=[#8:9])=[#8:11]>>[#6:10](=[#8:11])=[#8:12].[H]-[#6:8](-[#6:7])=[#8:9]

Source Full Reactions

EVODEX.1-R6792

Full Reaction Rendering

[H][O:11][C:9]([C:7]([C:6]1:[C:5]([H:15]):[C:4]([H:14]):[C:3]([C:2]([C:1]([H:21])([H:22])[H:23])([H:19])[H:20]):[C:13]([H:18]):[C:12]:1[H:17])=[O:8])=[O:10]>>[C:9](=[O:10])=[O:11].[H][C:7]([C:6]1:[C:5]([H:15]):[C:4]([H:14]):[C:3]([C:2]([C:1]([H:21])([H:22])[H:23])([H:19])[H:20]):[C:13]([H:18]):[C:12]:1[H:17])=[O:8]