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EVODEX.1-P4052

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F188 - Elemental Balance

C-3
H-6

EVODEX.1-M272 - Mass Difference

-42.04698

EVODEX.1-E884 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C501 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N618 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em67 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6]-[#6](-[H])(-[H])-[#8:3]-[#6:4]>>[H]-[#8:3]-[#6:4]

EVODEX.1-Cm8 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#8:2]>>[H]-[#8:2]

EVODEX.1-Nm81 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6]-[#6](-[H])(-[H])-[#8:3]-[#6:4]>>[H]-[#8:3]-[#6:4]

Source Full Reactions

EVODEX.1-R4895

Full Reaction Rendering

[C:1]([C:2]([C:3]([O:4][C:5](=[O:6])[C@@:7]([N:8]([H:16])[H:17])([C:9]1:[C:10]([H:18]):[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]:1[H:22])[H:23])([H:24])[H:25])([H:26])[H:27])([H:28])([H:29])[H:30].[H][O:15][H:31]>>[C:1]([C:2]([C:3]([O:15][H:31])([H:24])[H:25])([H:26])[H:27])([H:28])([H:29])[H:30].[H][O:4][C:5](=[O:6])[C@@:7]([N:8]([H:16])[H:17])([C:9]1:[C:10]([H:18]):[C:11]([H:19]):[C:12]([H:20]):[C:13]([H:21]):[C:14]:1[H:22])[H:23]