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EVODEX.1-P6061

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C([H])([H])C(=O)[C:8]([C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:26])([H:27])[H:28])([H:24])[H:25])([H:22])[H:23])([H:20])[H:21])([H:18])[H:19])=[O:7])([H:16])[H:17]>>[H][C:8]([C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:26])([H:27])[H:28])([H:24])[H:25])([H:22])[H:23])([H:20])[H:21])([H:18])[H:19])=[O:7])([H:16])[H:17]

Derived Operators

EVODEX.1-F98 - Elemental Balance

C-2
O-1
H-2

EVODEX.1-M186 - Mass Difference

-42.01056

EVODEX.1-E475 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#6](=[#8])-[#6:4](-[#6:5])(-[H:19])-[H:20])(-[H])(-[H])-[H]>>[#6:4](-[#6:5])(-[H:19])(-[H:20])-[H]

EVODEX.1-C365 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N418 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6](-[H])(-[H])-[#6](=[#8])-[#6:4](-[#6:5])(-[H:19])-[H:20]>>[H]-[#6:4](-[#6:5])(-[H:19])-[H:20]

EVODEX.1-Em464 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm30 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm417 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6686

Full Reaction Rendering

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