EVODEX Logo

EVODEX.1-P3942

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E183 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:6]-[#6@:7](-[#6:8])(-[H:25])-[#8:9]-[#6:10].[#8:13](-[H:30])-[H]>>([#6:6]-[#6:7](-[#6:8])(-[#8:13]-[H:30])-[H:25].[#6:10]-[#8:9]-[H])

EVODEX.1-C35 - Reaction Operator C

Reaction Operator C SMIRKS

[#8:7]-[#6@@:6].[H]-[#8:18]>>([H]-[#8:7].[#8:18]-[#6@@:6])

EVODEX.1-N626 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:6]-[#6:7](-[H:14])(-[#6:8])-[#8:12]-[#6:10].[H]-[#8:13]-[H:32]>>([H]-[#8:12]-[#6:10].[#6:8]-[#6:7](-[#6:6])(-[#8:13]-[H:32])-[H:14])

EVODEX.1-Em595 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:6]-[#6:7](-[#6:8])-[#8:12]-[#6:10].[H]-[#8:13]>>([H]-[#8:12]-[#6:10].[#6:8]-[#6:7](-[#6:6])-[#8:13])

EVODEX.1-Cm70 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:6]-[#8:7].[H]-[#8:18]>>([H]-[#8:7].[#6:6]-[#8:18])

EVODEX.1-Nm533 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:6]-[#6:7](-[#6:8])-[#8:12]-[#6:10].[H]-[#8:13]>>([H]-[#8:12]-[#6:10].[#6:8]-[#6:7](-[#6:6])-[#8:13])

Source Full Reactions

EVODEX.1-R4794

Full Reaction Rendering

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