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EVODEX.1-P124

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:4]([C:3]([C:2]([C:1]([H:28])([H:29])[H:30])([H:26])[H:27])([H:24])[H:25])([C:5]([H])([C:6]1:[C:7]([H:15]):[C:8]([H:16]):[C:9]([O:10][H:17]):[C:11]([H:18]):[C:12]:1[H:19])[H:20])[H:22]>>[C:1]([C:2]([C:3]([C:4](=[C:5]([C:6]1:[C:7]([H:15]):[C:8]([H:16]):[C:9]([O:10][H:17]):[C:11]([H:18]):[C:12]:1[H:19])[H:20])[H:22])([H:24])[H:25])([H:26])[H:27])([H:28])([H:29])[H:30]

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-E47 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:13]-[#6:14](-[#6:15](-[#6:16])(-[H:109])-[H])(-[H:111])-[H]>>[#6:13]-[#6:14](=[#6:15](-[#6:16])-[H:109])-[H:111]

EVODEX.1-C34 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:5]-[#6@:6]-[H]>>[#6:5]=[#6:6]

EVODEX.1-N82 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:5](-[#6:3])(-[#6:6](-[H])(-[#6:7])-[H:59])-[H:61]>>[#6:3]-[#6:5](=[#6:6](-[#6:7])-[H:59])-[H:61]

EVODEX.1-Em184 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm61 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:5]-[#6:6]-[H]>>[#6:5]=[#6:6]

EVODEX.1-Nm96 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R164

Full Reaction Rendering

[H][C:4]([C:3]([C:2]([C:1]([H:28])([H:29])[H:30])([H:26])[H:27])([H:24])[H:25])([C:5]([H])([C:6]1:[C:7]([H:15]):[C:8]([H:16]):[C:9]([O:10][H:17]):[C:11]([H:18]):[C:12]:1[H:19])[H:20])[H:22].[O:13]=[O:14]>>[C:1]([C:2]([C:3]([C:4](=[C:5]([C:6]1:[C:7]([H:15]):[C:8]([H:16]):[C:9]([O:10][H:17]):[C:11]([H:18]):[C:12]:1[H:19])[H:20])[H:22])([H:24])[H:25])([H:26])[H:27])([H:28])([H:29])[H:30].[H][O:13][O:14][H]