EVODEX Logo

EVODEX.1-P431

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:4]([N:2]([C:1]([H:31])([H:32])[H:33])[C:3]([H:22])([H:23])[H:24])([C:5]([P:6](=[O:7])([O:8][H:25])[O:9][H:26])([H:27])[H:28])[H:29]>>[H]O[C:4]([N:2]([C:1]([H:31])([H:32])[H:33])[C:3]([H:22])([H:23])[H:24])([C:5]([P:6](=[O:7])([O:8][H:25])[O:9][H:26])([H:27])[H:28])[H:29]

Derived Operators

EVODEX.1-F10 - Elemental Balance

O1

EVODEX.1-M6 - Mass Difference

15.9949

EVODEX.1-E409 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C4 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N160 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:24](-[#7:23])(-[#6:25])-[H:54]>>[H]-[#8]-[#6:24](-[#7:23])(-[#6:25])-[H:54]

EVODEX.1-Em242 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:24](-[#7:23])-[#6:25]>>[H]-[#8]-[#6:24](-[#7:23])-[#6:25]

EVODEX.1-Cm32 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

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

EVODEX.1-Nm240 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:24](-[#7:23])-[#6:25]>>[H]-[#8]-[#6:24](-[#7:23])-[#6:25]

Source Full Reactions

EVODEX.1-R411

Full Reaction Rendering

[H][C:4]([N:2]([C:1]([H:31])([H:32])[H:33])[C:3]([H:22])([H:23])[H:24])([C:5]([P:6](=[O:7])([O:8][H:25])[O:9][H:26])([H:27])[H:28])[H:29].[H][O:19][C:17]([C:15]([C:14]([C:13]([C:11](=[O:10])[O:12][H:34])([H:38])[H:39])([H:36])[H:37])=[O:16])=[O:18].[O:20]=[O:21]>>[C:17](=[O:18])=[O:19].[H][O:20][C:4]([N:2]([C:1]([H:31])([H:32])[H:33])[C:3]([H:22])([H:23])[H:24])([C:5]([P:6](=[O:7])([O:8][H:25])[O:9][H:26])([H:27])[H:28])[H:29].[H][O:21][C:15]([C:14]([C:13]([C:11](=[O:10])[O:12][H:34])([H:38])[H:39])([H:36])[H:37])=[O:16]