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EVODEX.1-P104

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:1]=[O:2].[H][O:3][C:4]([H])([C:5]([O:6][H:9])([C:7]([O:8][H:10])([H:11])[H:12])[H:13])[H:14]>>[O:3]=[C:4]([C:5]([O:6][H:9])([C:7]([O:8][H:10])([H:11])[H:12])[H:13])[H:14].[H][O:1][O:2][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E99 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:12]-[#6:13](-[#8:14]-[H])(-[H:25])-[H].[#8:17]=[#8:18]>>[#6:12]-[#6:13](=[#8:14])-[H:25].[#8:17](-[#8:18]-[H])-[H]

EVODEX.1-C40 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N81 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#6:5])-[H:21]>>[#8:3]=[#6:4](-[#6:5])-[H:21].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Em178 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:1]=[#8:2].[H]-[#6:19](-[#6:18])-[#8:20]-[H]>>[H]-[#8:1]-[#8:2]-[H].[#6:18]-[#6:19]=[#8:20]

EVODEX.1-Cm63 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm94 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R137

Full Reaction Rendering

[O:1]=[O:2].[H][O:3][C:4]([H])([C:5]([O:6][H:9])([C:7]([O:8][H:10])([H:11])[H:12])[H:13])[H:14]>>[O:3]=[C:4]([C:5]([O:6][H:9])([C:7]([O:8][H:10])([H:11])[H:12])[H:13])[H:14].[H][O:1][O:2][H]