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EVODEX.1-P5636

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C1:C([H]):C([H]):C(C(=O)[N:4]([C:5]([C:6]([O:7][H:17])([H:18])[H:19])([C:8](=[O:9])[O:10][H:20])[H:21])[H:22]):C([H]):C:1[H]>>[H][N:4]([C:5]([C:6]([O:7][H:17])([H:18])[H:19])([C:8](=[O:9])[O:10][H:20])[H:21])[H:22]

Derived Operators

EVODEX.1-F225 - Elemental Balance

O-1
C-7
H-4

EVODEX.1-M288 - Mass Difference

-104.02622

EVODEX.1-E942 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:8]-[#7:9](-[#6](=[#8])-[#6]1:[#6](-[H]):[#6](-[H]):[#6](-[H]):[#6](-[H]):[#6]:1-[H])-[H:26]>>[#6:8]-[#7:9](-[H:26])-[H]

EVODEX.1-C612 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6]1:[#6](-[H]):[#6](-[H]):[#6](-[#6](=[#8])-[#7:4]):[#6](-[H]):[#6]:1-[H]>>[H]-[#7:4]

EVODEX.1-N767 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6]1:[#6](-[H]):[#6](-[H]):[#6](-[#6](=[#8])-[#7:4](-[#6:5])-[H:35]):[#6](-[H]):[#6]:1-[H]>>[H]-[#7:4](-[#6:5])-[H:35]

EVODEX.1-Em1 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm1 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#7:7]>>[H]-[#7:7]

EVODEX.1-Nm1 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6361

Full Reaction Rendering

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