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EVODEX.1-P5712

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E355 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:5]-[#7:6](-[#6:7](-[#6:8])(-[H:24])-[H:25])-[H:26]>>[#8](-[#6:7](-[#6:8])(-[H:24])-[H:25])-[H].[#6:5]-[#7:6](-[H:26])-[H]

EVODEX.1-C23 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[H]-[#8]-[#6:5]

EVODEX.1-N1155 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:5]-[#7:6](-[#6:7](-[#6:8])(-[H:17])-[H:18])-[H:19]>>[H]-[#8]-[#6:7](-[#6:8])(-[H:17])-[H:18].[H]-[#7:6](-[#6:5])-[H:19]

EVODEX.1-Em676 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:5]-[#7:6]-[#6:7]-[#6:8]>>[H]-[#8]-[#6:7]-[#6:8].[H]-[#7:6]-[#6:5]

EVODEX.1-Cm18 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[#8]-[#6:5]

EVODEX.1-Nm609 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:5]-[#7:6]-[#6:7]-[#6:8]>>[H]-[#8]-[#6:7]-[#6:8].[H]-[#7:6]-[#6:5]

Source Full Reactions

EVODEX.1-R6423

Full Reaction Rendering

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