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EVODEX.1-P6371

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:1]([C:2]1:[C:3]([H:17]):[C:4]([H:18]):[C:5]([H:19]):[C:6]([C:7]([H:20])([H:21])[H:22]):[C:8]:1[H:23])([H:24])[H:25].[O:9]=[C:10]([O:11][H:27])[C:12](=[C:13]([C:14](=[O:15])[O:16][H:28])[H:29])[H:30]>>[H][C:12]([C:10](=[O:9])[O:11][H:27])([C:13]([C:1]([C:2]1:[C:3]([H:17]):[C:4]([H:18]):[C:5]([H:19]):[C:6]([C:7]([H:20])([H:21])[H:22]):[C:8]:1[H:23])([H:24])[H:25])([C:14](=[O:15])[O:16][H:28])[H:29])[H:30]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E268 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1](-[#6:2])(-[H:21])(-[H:22])-[H].[#8:9]=[#6:10]-[#6:12](=[#6:13](-[#6:14]=[#8:15])-[H:26])-[H:27]>>[#6:1](-[#6:2])(-[#6:13](-[#6:12](-[#6:10]=[#8:9])(-[H:27])-[H])(-[#6:14]=[#8:15])-[H:26])(-[H:21])-[H:22]

EVODEX.1-C742 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:1].[#6:12]=[#6:13]>>[H]-[#6:12]-[#6:13]-[#6:1]

EVODEX.1-N948 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:1](-[#6:2])(-[H:21])-[H:22].[#6:10]-[#6:12](=[#6:13](-[#6:14])-[H:26])-[H:27]>>[H]-[#6:12](-[#6:10])(-[#6:13](-[#6:1](-[#6:2])(-[H:21])-[H:22])(-[#6:14])-[H:26])-[H:27]

EVODEX.1-Em757 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:1]-[#6:2].[#8:9]=[#6:10]-[#6:12]=[#6:13]-[#6:14]=[#8:15]>>[H]-[#6:12](-[#6:10]=[#8:9])-[#6:13](-[#6:1]-[#6:2])-[#6:14]=[#8:15]

EVODEX.1-Cm295 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:1].[#6:12]=[#6:13]>>[H]-[#6:12]-[#6:13]-[#6:1]

EVODEX.1-Nm685 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:1]-[#6:2].[#6:10]-[#6:12]=[#6:13]-[#6:14]>>[H]-[#6:12](-[#6:10])-[#6:13](-[#6:1]-[#6:2])-[#6:14]

Source Full Reactions

EVODEX.1-R6969

Full Reaction Rendering

[H][C:1]([C:2]1:[C:3]([H:17]):[C:4]([H:18]):[C:5]([H:19]):[C:6]([C:7]([H:20])([H:21])[H:22]):[C:8]:1[H:23])([H:24])[H:25].[O:9]=[C:10]([O:11][H:27])[C:12](=[C:13]([C:14](=[O:15])[O:16][H:28])[H:29])[H:30]>>[H][C:12]([C:10](=[O:9])[O:11][H:27])([C:13]([C:1]([C:2]1:[C:3]([H:17]):[C:4]([H:18]):[C:5]([H:19]):[C:6]([C:7]([H:20])([H:21])[H:22]):[C:8]:1[H:23])([H:24])[H:25])([C:14](=[O:15])[O:16][H:28])[H:29])[H:30]