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EVODEX.1-P236

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]1:[C:3]([H:13]):[C:4]([C:5]([H:14])([H:15])[H:16]):[C:6]([O:7][H:17]):[C:8]([O:9][H:18]):[C:10]:1[H:19])([H:20])([H:21])[H:22]>>O=[C:8]([C:6](=[C:4]([C:3](=[C:2]([C:1]([H:20])([H:21])[H:22])[C:10](=O)[H:19])[H:13])[C:5]([H:14])([H:15])[H:16])[O:7][H:17])[O:9][H:18]

Derived Operators

EVODEX.1-F64 - Elemental Balance

O2

EVODEX.1-M19 - Mass Difference

31.9898

EVODEX.1-E604 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]1:[#6:3]:[#6:4]:[#6:5]:[#6:7](-[H:14]):[#6:8]:1-[#8:9]>>[#6:2](=[#6:3]-[#6:4]=[#6:5]-[#6:7](=[#8])-[H:14])-[#6:8](-[#8:9])=[#8]

EVODEX.1-C49 - Reaction Operator C

Reaction Operator C SMIRKS

nan

EVODEX.1-N135 - Reaction Operator N

Reaction Operator N SMIRKS

nan

EVODEX.1-Em218 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:2]1:[#6:3]:[#6:4]:[#6:5]:[#6:7](-[#8:8]):[#6:9]:1>>[#8]=[#6:7](-[#6:5]=[#6:4]-[#6:3]=[#6:2]-[#6:9]=[#8])-[#8:8]

EVODEX.1-Cm91 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

nan

EVODEX.1-Nm217 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

nan

Source Full Reactions

EVODEX.1-R277

Full Reaction Rendering

[C:1]([C:2]1:[C:3]([H:13]):[C:4]([C:5]([H:14])([H:15])[H:16]):[C:6]([O:7][H:17]):[C:8]([O:9][H:18]):[C:10]:1[H:19])([H:20])([H:21])[H:22].[O:11]=[O:12]>>[C:1]([C:2](=[C:3]([C:4]([C:5]([H:14])([H:15])[H:16])=[C:6]([O:7][H:17])[C:8]([O:9][H:18])=[O:11])[H:13])[C:10](=[O:12])[H:19])([H:20])([H:21])[H:22]