EVODEX.1-P6589

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:1]=[P:2]([O:3][H:28])([O:4][H:29])[O:5][C@@:6]1([H:30])[O:7][C@@:8]([C:9]([O:10][H:31])([H:32])[H:33])([H:34])[C@:11]([O:12][H:35])([H:36])[C@@:13]([O:14][H:37])([H:38])[C@:15]1([O:16][H:39])[H:40].[H][O:17][C:18]([C@@:19]1([H:41])[O:20][C@:21]([O:22][H:42])([H:43])[C:23]([H:44])([H:45])[C@:24]([O:25][H:46])([H:47])[C@@:26]1([O:27][H:48])[H:49])([H:50])[H:51]>>[O:1]=[P:2]([O:3][H:28])([O:4][H:29])[O:17][C:18]([C@@:19]1([H:41])[O:20][C@:21]([O:22][H:42])([H:43])[C:23]([H:44])([H:45])[C@:24]([O:25][H:46])([H:47])[C@@:26]1([O:27][H:48])[H:49])([H:50])[H:51].[H][O:5][C:6]1([H:30])[O:7][C@@:8]([C:9]([O:10][H:31])([H:32])[H:33])([H:34])[C@:11]([O:12][H:35])([H:36])[C@@:13]([O:14][H:37])([H:38])[C@:15]1([O:16][H:39])[H:40]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E297 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:7]-[#8:8]-[H].[#8:14]=[#15:15](-[#8:16])(-[#8:17])-[#8:18]-[#6@@:19](-[H:46])(-[#8:20])-[#6@:28]>>[#6:7]-[#8:8]-[#15:15](=[#8:14])(-[#8:16])-[#8:17].[#8:18](-[#6:19](-[H:46])(-[#8:20])-[#6@:28])-[H]

EVODEX.1-C882 - Reaction Operator C

Reaction Operator C SMIRKS

[#15:14]-[#8:17]-[#6@@:18].[H]-[#8:12]>>[#8:12]-[#15:14].[H]-[#8:17]-[#6:18]

EVODEX.1-N1105 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:13]=[#15:14](-[#8:15])(-[#8:16])-[#8:17]-[#6@@:18](-[H:31])(-[#8:19])-[#6@:27].[H]-[#8:12]-[#6:11]>>[#6:11]-[#8:12]-[#15:14](=[#8:13])(-[#8:15])-[#8:16].[H]-[#8:17]-[#6:18](-[H:31])(-[#8:19])-[#6@:27]

EVODEX.1-Em66 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:13]=[#15:14](-[#8:15])(-[#8:16])-[#8:17]-[#6:18].[H]-[#8:12]-[#6:11]>>[#6:11]-[#8:12]-[#15:14](=[#8:13])(-[#8:15])-[#8:16].[H]-[#8:17]-[#6:18]

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-Nm79 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8:13]=[#15:14](-[#8:15])(-[#8:16])-[#8:17]-[#6:18].[H]-[#8:12]-[#6:11]>>[#6:11]-[#8:12]-[#15:14](=[#8:13])(-[#8:15])-[#8:16].[H]-[#8:17]-[#6:18]

Source Full Reactions

EVODEX.1-R7170

Full Reaction Rendering

[O:1]=[P:2]([O:3][H:28])([O:4][H:29])[O:5][C@@:6]1([H:30])[O:7][C@@:8]([C:9]([O:10][H:31])([H:32])[H:33])([H:34])[C@:11]([O:12][H:35])([H:36])[C@@:13]([O:14][H:37])([H:38])[C@:15]1([O:16][H:39])[H:40].[H][O:17][C:18]([C@@:19]1([H:41])[O:20][C@:21]([O:22][H:42])([H:43])[C:23]([H:44])([H:45])[C@:24]([O:25][H:46])([H:47])[C@@:26]1([O:27][H:48])[H:49])([H:50])[H:51]>>[O:1]=[P:2]([O:3][H:28])([O:4][H:29])[O:17][C:18]([C@@:19]1([H:41])[O:20][C@:21]([O:22][H:42])([H:43])[C:23]([H:44])([H:45])[C@:24]([O:25][H:46])([H:47])[C@@:26]1([O:27][H:48])[H:49])([H:50])[H:51].[H][O:5][C:6]1([H:30])[O:7][C@@:8]([C:9]([O:10][H:31])([H:32])[H:33])([H:34])[C@:11]([O:12][H:35])([H:36])[C@@:13]([O:14][H:37])([H:38])[C@:15]1([O:16][H:39])[H:40]