EVODEX.1-P5763

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([C:5](=[O:6])[C@@:7]([N:8]([H:23])[H:24])([C:9]([C:10](=[O:11])[O:12][H:25])([H:26])[H:27])[H:28])[C@@:13]([C:14]([C:15]([C:16](=[O:17])[O:18][H:29])([H:30])[H:31])([H:32])[H:33])([C:19](=[O:20])[O:21][H:34])[H:35])([H:36])([H:37])[H:38].[H][O:22][H:39]>>[C:1]([C:2](=[O:3])[O:22][H:39])([H:36])([H:37])[H:38].[H][N:4]([C:5](=[O:6])[C@@:7]([N:8]([H:23])[H:24])([C:9]([C:10](=[O:11])[O:12][H:25])([H:26])[H:27])[H:28])[C@@:13]([C:14]([C:15]([C:16](=[O:17])[O:18][H:29])([H:30])[H:31])([H:32])[H:33])([C:19](=[O:20])[O:21][H:34])[H:35]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E207 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#6:5])-[#6@@:13].[#8:22](-[H:39])-[H]>>[#6:1]-[#6:2](=[#8:3])-[#8:22]-[H:39].[#7:4](-[#6:5])(-[#6@@:13])-[H]

EVODEX.1-C12 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-N1260 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#6:5])-[#6@@:13].[H]-[#8:22]-[H:39]>>[#6:1]-[#6:2](=[#8:3])-[#8:22]-[H:39].[H]-[#7:4](-[#6:5])-[#6@@:13]

EVODEX.1-Em645 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#6:5])-[#6:13].[H]-[#8:22]>>[#6:1]-[#6:2](=[#8:3])-[#8:22].[H]-[#7:4](-[#6:5])-[#6:13]

EVODEX.1-Cm24 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-Nm580 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#6:5])-[#6:13].[H]-[#8:22]>>[#6:1]-[#6:2](=[#8:3])-[#8:22].[H]-[#7:4](-[#6:5])-[#6:13]

Source Full Reactions

EVODEX.1-R6459

Full Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([C:5](=[O:6])[C@@:7]([N:8]([H:23])[H:24])([C:9]([C:10](=[O:11])[O:12][H:25])([H:26])[H:27])[H:28])[C@@:13]([C:14]([C:15]([C:16](=[O:17])[O:18][H:29])([H:30])[H:31])([H:32])[H:33])([C:19](=[O:20])[O:21][H:34])[H:35])([H:36])([H:37])[H:38].[H][O:22][H:39]>>[C:1]([C:2](=[O:3])[O:22][H:39])([H:36])([H:37])[H:38].[H][N:4]([C:5](=[O:6])[C@@:7]([N:8]([H:23])[H:24])([C:9]([C:10](=[O:11])[O:12][H:25])([H:26])[H:27])[H:28])[C@@:13]([C:14]([C:15]([C:16](=[O:17])[O:18][H:29])([H:30])[H:31])([H:32])[H:33])([C:19](=[O:20])[O:21][H:34])[H:35]