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EVODEX.1-P6593

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E107 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1](-[#6@@:2](-[#6:3](-[#6:4])(-[H:14])-[H])(-[#6:8])-[H:17])(-[H:18])-[H:19]>>[#7:1](-[#6:3](-[#6:2](-[#6:8])(-[H:17])-[H])(-[#6:4])-[H:14])(-[H:18])-[H:19]

EVODEX.1-C761 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:5]-[#6@:6]-[#7:7]>>[H]-[#6:6]-[#6@@:5]-[#7:7]

EVODEX.1-N972 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:5](-[#6:4])(-[#6@:6](-[#7:7](-[H:11])-[H:12])(-[#6:8])-[H:14])-[H:15]>>[H]-[#6:6](-[#6@@:5](-[#6:4])(-[#7:7](-[H:11])-[H:12])-[H:15])(-[#6:8])-[H:14]

EVODEX.1-Em789 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:5](-[#6:4])-[#6:6](-[#7:7])-[#6:8]>>[H]-[#6:6](-[#6:5](-[#6:4])-[#7:7])-[#6:8]

EVODEX.1-Cm313 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:5]-[#6:6]-[#7:7]>>[H]-[#6:6]-[#6:5]-[#7:7]

EVODEX.1-Nm710 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:5](-[#6:4])-[#6:6](-[#7:7])-[#6:8]>>[H]-[#6:6](-[#6:5](-[#6:4])-[#7:7])-[#6:8]

Source Full Reactions

EVODEX.1-R7174

Full Reaction Rendering

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