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EVODEX.1-P4224

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OP(=O)(O[H])O[C:6]([C@:5]([C:3](=[O:2])[O:4][H:24])([O:12][C@@:13]1([H:29])[O:14][C@@:15]([C:16]([O:17][H:30])([H:31])[H:32])([H:33])[C@:18]([O:19][H:34])([H:35])[C@@:20]([O:21][H:36])([H:37])[C@@:22]1([O:23][H:38])[H:39])[H:40])([H:27])[H:28]>>[H]O[C:6]([C@:5]([C:3](=[O:2])[O:4][H:24])([O:12][C@@:13]1([H:29])[O:14][C@@:15]([C:16]([O:17][H:30])([H:31])[H:32])([H:33])[C@:18]([O:19][H:34])([H:35])[C@@:20]([O:21][H:36])([H:37])[C@@:22]1([O:23][H:38])[H:39])[H:40])([H:27])[H:28]

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-C46 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]>>[H]-[#8]

EVODEX.1-N101 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8]-[#15](=[#8])(-[#8]-[H])-[#8]>>[H]-[#8]

Source Full Reactions

EVODEX.1-R5073

Full Reaction Rendering

[O:2]=[C:3]([O:4][H:24])[C@@:5]([C:6]([O:7][P:8](=[O:9])([O:10][H:25])[O:11][H:26])([H:27])[H:28])([O:12][C@@:13]1([H:29])[O:14][C@@:15]([C:16]([O:17][H:30])([H:31])[H:32])([H:33])[C@:18]([O:19][H:34])([H:35])[C@@:20]([O:21][H:36])([H:37])[C@@:22]1([O:23][H:38])[H:39])[H:40].[H][O:1][H:41]>>[O:1]([C:6]([C@:5]([C:3](=[O:2])[O:4][H:24])([O:12][C@@:13]1([H:29])[O:14][C@@:15]([C:16]([O:17][H:30])([H:31])[H:32])([H:33])[C@:18]([O:19][H:34])([H:35])[C@@:20]([O:21][H:36])([H:37])[C@@:22]1([O:23][H:38])[H:39])[H:40])([H:27])[H:28])[H:41].[H][O:7][P:8](=[O:9])([O:10][H:25])[O:11][H:26]