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EVODEX.1-P5870

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F73 - Elemental Balance

N-1
H-3

EVODEX.1-M12 - Mass Difference

-17.02659

EVODEX.1-E625 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:5]-[#6:6](=[#7]-[H])-[H:16].[#8:11](-[H])-[H]>>[#7:5]-[#6:6](=[#8:11])-[H:16]

EVODEX.1-C1020 - Reaction Operator C

Reaction Operator C SMIRKS

([H]-[#7]=[#6:6].[#6@@:4]).[H]-[#8:11]-[H]>>([#6:6]=[#8:11].[#6@:4])

EVODEX.1-N1274 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7]=[#6:6](-[#7:5]-[#6@@:4](-[#6:2])(-[#6:8])-[H:19])-[H:16].[H]-[#8:11]-[H]>>[#6:2]-[#6@:4](-[#7:5]-[#6:6](=[#8:11])-[H:16])(-[#6:8])-[H:19]

EVODEX.1-Em683 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7]=[#6:6]-[#7:5].[H]-[#8:11]-[H]>>[#7:5]-[#6:6]=[#8:11]

EVODEX.1-Cm276 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]=[#6:6].[H]-[#8:11]-[H]>>[#6:6]=[#8:11]

EVODEX.1-Nm616 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7]=[#6:6]-[#7:5].[H]-[#8:11]-[H]>>[#7:5]-[#6:6]=[#8:11]

Source Full Reactions

EVODEX.1-R6548

Full Reaction Rendering

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