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EVODEX.1-P5512

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OC(=O)C([H])(N([H])[C:2]([C:1]([H:18])([H:19])[H:20])=[O:3])C([H])([H])O[H].[H][O:11][H:21]>>[C:1]([C:2](=[O:3])[O:11][H:21])([H:18])([H:19])[H:20]

Derived Operators

EVODEX.1-F61 - Elemental Balance

C-3
O-3
N-1
H-7

EVODEX.1-M562 - Mass Difference

-105.04261

EVODEX.1-E597 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:2]=[#6:3](-[#7](-[#6](-[#6](-[#8]-[H])(-[H])-[H])(-[#6](=[#8])-[#8]-[H])-[H])-[H])-[#6:11].[#8:1](-[H:28])-[H]>>[#8:1](-[#6:3](=[#8:2])-[#6:11])-[H:28]

EVODEX.1-C1011 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[#7](-[H])-[#6:2])-[#6](-[H])(-[H])-[#8]-[H].[H]-[#8:11]>>[#6:2]-[#8:11]

EVODEX.1-N1264 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8]-[#6](=[#8])-[#6](-[H])(-[#7](-[H])-[#6:2](-[#6:1])=[#8:3])-[#6](-[H])(-[H])-[#8]-[H].[H]-[#8:11]-[H:21]>>[#6:1]-[#6:2](=[#8:3])-[#8:11]-[H:21]

EVODEX.1-Em2 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7](-[#6])-[#6:4](-[#6:3])=[#8:5].[H]-[#8:13]>>[#6:3]-[#6:4](=[#8:5])-[#8:13]

EVODEX.1-Cm3 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]-[#6:4].[H]-[#8:13]>>[#6:4]-[#8:13]

EVODEX.1-Nm2 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7](-[#6])-[#6:4](-[#6:3])=[#8:5].[H]-[#8:13]>>[#6:3]-[#6:4](=[#8:5])-[#8:13]

Source Full Reactions

EVODEX.1-R6251

Full Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([C:5]([C:6]([O:7][H:12])([H:13])[H:14])([C:8](=[O:9])[O:10][H:15])[H:16])[H:17])([H:18])([H:19])[H:20].[H][O:11][H:21]>>[C:1]([C:2](=[O:3])[O:11][H:21])([H:18])([H:19])[H:20].[H][N:4]([C:5]([C:6]([O:7][H:12])([H:13])[H:14])([C:8](=[O:9])[O:10][H:15])[H:16])[H:17]