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EVODEX.1-P3086

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-C14 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6@@:14]-[#7:13].[#6:8]=[#8:9]>>[H]-[#6@:8]-[#7:13].[#8:9]=[#6:14]

EVODEX.1-N76 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6@:2](-[#7:1](-[H:31])-[H:32])(-[#6:3])-[#6:10].[#8:13]=[#6:14](-[#6:15])-[H:38]>>[#6:2](-[#6:3])(-[#6:10])=[#8:13].[H]-[#6:14](-[#7:1](-[H:31])-[H:32])(-[#6:15])-[H:38]

EVODEX.1-Em551 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:10]=[#8:11].[#8:13]=[#6:14]-[#6:15]=[#8:16]>>[#6:2](-[#6:3])(-[#6:10]=[#8:11])=[#8:13].[H]-[#6:14](-[#7:1])-[#6:15]=[#8:16]

EVODEX.1-Cm49 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:14]-[#7:13].[#6:8]=[#8:9]>>[H]-[#6:8]-[#7:13].[#8:9]=[#6:14]

EVODEX.1-Nm140 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:10].[#8:13]=[#6:14]-[#6:15]>>[#6:2](-[#6:3])(-[#6:10])=[#8:13].[H]-[#6:14](-[#7:1])-[#6:15]

Source Full Reactions

EVODEX.1-R3755

Full Reaction Rendering

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