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EVODEX.1-P217

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]1=[C:3]([H:13])[C:4]([H:14])([H:15])[C:5]([C:6]([C:7]([H:16])([H:17])[H:18])([C:8]([H:19])([H:20])[H:21])[H:22])=[C:9]([H:23])[C:10]1([H:24])[H:25])([H:26])([H:27])[H:28]>>O1[C:2]2([C:1]([H:26])([H:27])[H:28])[C:3]1([H:13])[C:4]([H:14])([H:15])[C:5]([C:6]([C:7]([H:16])([H:17])[H:18])([C:8]([H:19])([H:20])[H:21])[H:22])=[C:9]([H:23])[C:10]2([H:24])[H:25]

Derived Operators

EVODEX.1-F10 - Elemental Balance

O1

EVODEX.1-M6 - Mass Difference

15.9949

EVODEX.1-E423 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:19](-[#6@:8])(-[#6@:17])=[#6:20](-[H:89])-[#6:21]>>[H:89]-[#6@:20]1(-[#6@@:19](-[#6@:8])(-[#6@:17])-[#8]-1)-[#6:21]

EVODEX.1-C92 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:27]=[#6:28]>>[#8]1-[#6@:27]-[#6:28]-1

EVODEX.1-N129 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:26]-[#6:27](=[#6:28](-[#6:29])-[#6:30])-[H:102]>>[#8]1-[#6@:27](-[#6:26])(-[H:102])-[#6:28]-1(-[#6:29])-[#6:30]

EVODEX.1-Em211 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:26]-[#6:27]=[#6:28](-[#6:29])-[#6:30]>>[#8]1-[#6:27](-[#6:26])-[#6:28]-1(-[#6:29])-[#6:30]

EVODEX.1-Cm118 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:27]=[#6:28]>>[#8]1-[#6:27]-[#6:28]-1

EVODEX.1-Nm211 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:26]-[#6:27]=[#6:28](-[#6:29])-[#6:30]>>[#8]1-[#6:27](-[#6:26])-[#6:28]-1(-[#6:29])-[#6:30]

Source Full Reactions

EVODEX.1-R260

Full Reaction Rendering

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