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EVODEX.1-P4186

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[N:1]([C:2]1:[N:3]:[C:4]([H:29]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:30]):[N:10]:2[C@:11]1([H:31])[O:12][C@@:13]([C:14]([O:15][P:16](=[O:17])([O:18][H:32])[O:19][P:20](=[O:21])([O:22][H:33])[O:23][H:34])([H:35])[H:36])([H:37])[C@:24]([O:25][H:38])([H:39])[C@:26]1([O:27][H:40])[H:41])([H:42])[H:43].[H][O:28][H:44]>>[H][O:15][C:14]([C@@:13]1([H:37])[O:12][C@:11]([N:10]2:[C:6]3:[N:5]:[C:4]([H:29]):[N:3]:[C:2]([N:1]([H:42])[H:43]):[C:7]:3:[N:8]:[C:9]:2[H:30])([H:31])[C@@:26]([O:27][H:40])([H:41])[C@@:24]1([O:25][H:38])[H:39])([H:35])[H:36].[P:16](=[O:17])([O:18][H:32])([O:19][P:20](=[O:21])([O:22][H:33])[O:23][H:34])[O:28][H:44]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E211 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:14](-[#6@@:13])-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[#8:39](-[H:64])-[H]>>[#8:14](-[#6@@:13])-[H].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]-[H:64]

EVODEX.1-C22 - Reaction Operator C

Reaction Operator C SMIRKS

([#8:10]-[#15:11].[#6@:15]-[#6@:17]).[H]-[#8:35]>>([H]-[#8:10].[#6@@:17]-[#6@@:15]).[#15:11]-[#8:35]

EVODEX.1-N1369 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:14](-[#6@@:13]-[#6@:24](-[#8:25])(-[H:39])-[#6@:26](-[#6@:11])(-[#8:27])-[H:41])-[#8:15]-[#15:16](=[#8:17])(-[#8:18])-[#8:19].[H]-[#8:28]-[H:44]>>[H]-[#8:15]-[#6:14]-[#6@@:13]-[#6@:24](-[#6@:26](-[#6@:11])(-[#8:27])-[H:41])(-[#8:25])-[H:39].[#15:16](=[#8:17])(-[#8:18])(-[#8:19])-[#8:28]-[H:44]

EVODEX.1-Em615 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:13]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:39]>>[H]-[#8:14]-[#6:13].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]

EVODEX.1-Cm13 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#8:21].[#15:45]-[#8:48]>>[#8:21]-[#15:45].[H]-[#8:48]

EVODEX.1-Nm550 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:13]-[#8:14]-[#15:15](=[#8:16])(-[#8:17])-[#8:18].[H]-[#8:39]>>[H]-[#8:14]-[#6:13].[#15:15](=[#8:16])(-[#8:17])(-[#8:18])-[#8:39]

Source Full Reactions

EVODEX.1-R5028

Full Reaction Rendering

[N:1]([C:2]1:[N:3]:[C:4]([H:29]):[N:5]:[C:6]2:[C:7]:1:[N:8]:[C:9]([H:30]):[N:10]:2[C@:11]1([H:31])[O:12][C@@:13]([C:14]([O:15][P:16](=[O:17])([O:18][H:32])[O:19][P:20](=[O:21])([O:22][H:33])[O:23][H:34])([H:35])[H:36])([H:37])[C@:24]([O:25][H:38])([H:39])[C@:26]1([O:27][H:40])[H:41])([H:42])[H:43].[H][O:28][H:44]>>[H][O:15][C:14]([C@@:13]1([H:37])[O:12][C@:11]([N:10]2:[C:6]3:[N:5]:[C:4]([H:29]):[N:3]:[C:2]([N:1]([H:42])[H:43]):[C:7]:3:[N:8]:[C:9]:2[H:30])([H:31])[C@@:26]([O:27][H:40])([H:41])[C@@:24]1([O:25][H:38])[H:39])([H:35])[H:36].[P:16](=[O:17])([O:18][H:32])([O:19][P:20](=[O:21])([O:22][H:33])[O:23][H:34])[O:28][H:44]