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EVODEX.1-P1160

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-E48 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1](-[#7:2](-[#6:3])-[H:24])(-[H:25])(-[H:26])-[H].[#8:12](-[H])-[H]>>[#6:1](=[#8:12])(-[H:25])-[H:26].[#7:2](-[#6:3])(-[H:24])-[H]

EVODEX.1-C19 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:1]-[#7:2].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]

EVODEX.1-N259 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:1](-[#7:2](-[#6:3])-[H:27])(-[H:28])-[H:29].[H]-[#8:12]-[H]>>[#6:1](=[#8:12])(-[H:28])-[H:29].[H]-[#7:2](-[#6:3])-[H:27]

EVODEX.1-Em380 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:1]-[#7:2]-[#6:3].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]-[#6:3]

EVODEX.1-Cm56 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:1]-[#7:2].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]

EVODEX.1-Nm340 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:1]-[#7:2]-[#6:3].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2]-[#6:3]

Source Full Reactions

EVODEX.1-R1089

Full Reaction Rendering

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