EVODEX Logo

EVODEX.1-P4192

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OP(=O)(O[H])O[C:3](=[O:2])[C:9]([O:10][H:15])([C:11]([O:12][H:16])([H:17])[H:18])[H:19]>>[H]O[C:3](=[O:2])[C@:9]([O:10][H:15])([C:11]([O:12][H:16])([H:17])[H:18])[H:19]

Derived Operators

EVODEX.1-F114 - Elemental Balance

P-1
O-3
H-1

EVODEX.1-M33 - Mass Difference

-79.96633

EVODEX.1-E730 - Reaction Operator E

Reaction Operator E SMIRKS

[#8](-[#6@@:12]-[#6@@:18](-[#6@@:8])(-[#8:19])-[H:29])-[#15](=[#8])(-[#8]-[H])-[#8]-[H]>>[#8](-[#6@@:12]-[#6@@:18](-[#6@@:8])(-[#8:19])-[H:29])-[H]

EVODEX.1-C1372 - Reaction Operator C

Reaction Operator C SMIRKS

([H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8].[#6:9])>>([H]-[#8].[#6@:9])

EVODEX.1-N1738 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]-[#6:3]-[#6:9](-[#8:10])(-[#6:11])-[H:19]>>[H]-[#8]-[#6:3]-[#6@:9](-[#8:10])(-[#6:11])-[H:19]

Source Full Reactions

EVODEX.1-R5041

Full Reaction Rendering

[O:2]=[C:3]([O:4][P:5](=[O:6])([O:7][H:13])[O:8][H:14])[C:9]([O:10][H:15])([C:11]([O:12][H:16])([H:17])[H:18])[H:19].[H][O:1][H:20]>>[O:1]([C:3](=[O:2])[C@:9]([O:10][H:15])([C:11]([O:12][H:16])([H:17])[H:18])[H:19])[H:20].[H][O:4][P:5](=[O:6])([O:7][H:13])[O:8][H:14]