EVODEX Logo

EVODEX.1-P4058

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]O[C:1]([H:14])([H:15])[H:16].[H][O:12][C:10]([C:9]([C@:7]([C:5]([O:4][C:3]([H:23])([H:24])[H:25])=[O:6])([N:8]([H:17])[H:18])[H:22])([H:20])[H:21])=[O:11]>>[C:1]([O:12][C:10]([C:9]([C@:7]([C:5]([O:4][C:3]([H:23])([H:24])[H:25])=[O:6])([N:8]([H:17])[H:18])[H:22])([H:20])[H:21])=[O:11])([H:14])([H:15])[H:16]

Derived Operators

EVODEX.1-F33 - Elemental Balance

O-1
H-2

EVODEX.1-M4 - Mass Difference

-18.010559999999998

EVODEX.1-E480 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:7]-[#8:9]-[H]>>[#6](-[#8:9]-[#6:7])(-[H])(-[H])-[H]

EVODEX.1-C88 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8:7].[H]-[#8]-[#6:11]>>[#8:7]-[#6:11]

EVODEX.1-N271 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8]-[#6:1](-[H:14])(-[H:15])-[H:16].[H]-[#8:12]-[#6:10]>>[#6:1](-[#8:12]-[#6:10])(-[H:14])(-[H:15])-[H:16]

EVODEX.1-Em395 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#8]-[#6:1].[H]-[#8:12]-[#6:10]>>[#6:1]-[#8:12]-[#6:10]

EVODEX.1-Cm6 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#8:7].[#8]-[#6:11]>>[#8:7]-[#6:11]

EVODEX.1-Nm355 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#8]-[#6:1].[H]-[#8:12]-[#6:10]>>[#6:1]-[#8:12]-[#6:10]

Source Full Reactions

EVODEX.1-R4901

Full Reaction Rendering

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