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EVODEX.1-P144

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:7]([C:6](=[C:5]([C:4]([C:3]([C:2]([C:1]([H:22])([H:23])[H:24])([H:20])[H:21])([H:18])[H:19])([H:16])[H:17])[H:15])[H:14])([O:8][H])[H:12]>>[C:1]([C:2]([C:3]([C:4]([C:5](=[C:6]([C:7](=[O:8])[H:12])[H:14])[H:15])([H:16])[H:17])([H:18])[H:19])([H:20])[H:21])([H:22])([H:23])[H:24]

Derived Operators

EVODEX.1-F4 - Elemental Balance

H-2

EVODEX.1-M5 - Mass Difference

-2.01566

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-Em152 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

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-R186

Full Reaction Rendering

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