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EVODEX.1-P105

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

EVODEX.1-E40 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:10](-[#6@:9])(-[#8:11]-[H])(-[H:191])-[H]>>[#6:10](-[#6@:9])(=[#8:11])-[H:191]

EVODEX.1-C33 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N22 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:7](-[#6:6])(-[#8:8]-[H])-[H:12]>>[#6:6]-[#6:7](=[#8:8])-[H:12]

EVODEX.1-Em77 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:9](-[#6:8])-[#8:10]-[H]>>[#6:8]-[#6:9]=[#8:10]

EVODEX.1-Cm43 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:50]-[#8:51]-[H]>>[#6:50]=[#8:51]

EVODEX.1-Nm51 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R138

Full Reaction Rendering

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