EVODEX.1-P1343

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E229 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:1]-[#6:2](=[#8:3])-[#8:4]-[#15:5].[#7:9](-[#6:10])(-[H:26])-[H]>>[#7:1]-[#6:2](=[#8:3])-[#7:9](-[#6:10])-[H:26].[#8:4](-[#15:5])-[H]

EVODEX.1-C959 - Reaction Operator C

Reaction Operator C SMIRKS

([H]-[#7:11].[#6@:5]).[#6:18]-[#8:20]>>([#7:11]-[#6:18].[#6@@:5]).[H]-[#8:20]

EVODEX.1-N1302 - Reaction Operator N

Reaction Operator N SMIRKS

([H]-[#7:11](-[#6:10])-[H:37].[#7:3]-[#6@@:2](-[#6:1])(-[#6:12])-[H:62]).[#7:27]-[#6:28](=[#8:29])-[#8:30]-[#15:31]>>([#6:1]-[#6@:2](-[#7:3])(-[#6:12])-[H:62].[#6:10]-[#7:11](-[#6:28](-[#7:27])=[#8:29])-[H:37]).[H]-[#8:30]-[#15:31]

EVODEX.1-Em411 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#7:1]-[#6:2](=[#8:3])-[#8:4]-[#15:5].[H]-[#7:9]-[#6:10]>>[#7:1]-[#6:2](=[#8:3])-[#7:9]-[#6:10].[H]-[#8:4]-[#15:5]

EVODEX.1-Cm34 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:2]-[#8:4].[H]-[#7:19]>>[#6:2]-[#7:19].[H]-[#8:4]

EVODEX.1-Nm371 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#7:1]-[#6:2](=[#8:3])-[#8:4]-[#15:5].[H]-[#7:9]-[#6:10]>>[#7:1]-[#6:2](=[#8:3])-[#7:9]-[#6:10].[H]-[#8:4]-[#15:5]

Source Full Reactions

EVODEX.1-R1863

Full Reaction Rendering

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