EVODEX.1-P4362

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([S:2][C:3]([C:4]([C:5]([C:6]([C:7]([C:8](=[N:9][O:10][S:11](=[O:12])(=[O:13])[O:14][H:28])[S:15][C@:16]1([H:29])[O:17][C@@:18]([C:19]([O:20][H:30])([H:31])[H:32])([H:33])[C@:21]([O:22][H:34])([H:35])[C@@:23]([O:24][H:36])([H:37])[C@:25]1([O:26][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])([H:51])[H:52].[H][O:27][H:53]>>[C@@:16]1([O:27][H:53])([H:29])[O:17][C@@:18]([C:19]([O:20][H:30])([H:31])[H:32])([H:33])[C@:21]([O:22][H:34])([H:35])[C@@:23]([O:24][H:36])([H:37])[C@:25]1([O:26][H:38])[H:39].[H][S:15][C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([S:2][C:1]([H:50])([H:51])[H:52])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])([H:42])[H:43])([H:40])[H:41])=[N:9][O:10][S:11](=[O:12])(=[O:13])[O:14][H:28]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E179 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:8]-[#16:17]-[#6@:18](-[H:37])(-[#8:19])-[#6@:27].[#8:1](-[H:48])-[H]>>[#6:8]-[#16:17]-[H].[#8:1](-[#6@:18](-[H:37])(-[#8:19])-[#6@:27])-[H:48]

EVODEX.1-C2 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:24]-[#16:26].[H]-[#8:34]>>[#6:24]-[#8:34].[H]-[#16:26]

EVODEX.1-N679 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:9]-[#16:16]-[#6@:17](-[H:34])(-[#8:18])-[#6@:26].[H]-[#8:30]-[H:54]>>[#8:30](-[#6@:17](-[H:34])(-[#8:18])-[#6@:26])-[H:54].[H]-[#16:16]-[#6:9]

EVODEX.1-Em637 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:9]-[#16:16]-[#6:17](-[#8:18])-[#6:26].[H]-[#8:30]>>[#6:17](-[#8:30])(-[#8:18])-[#6:26].[H]-[#16:16]-[#6:9]

EVODEX.1-Cm23 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:24]-[#16:26].[H]-[#8:34]>>[#6:24]-[#8:34].[H]-[#16:26]

EVODEX.1-Nm572 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:9]-[#16:16]-[#6:17](-[#8:18])-[#6:26].[H]-[#8:30]>>[#6:17](-[#8:30])(-[#8:18])-[#6:26].[H]-[#16:16]-[#6:9]

Source Full Reactions

EVODEX.1-R5202

Full Reaction Rendering

[C:1]([S:2][C:3]([C:4]([C:5]([C:6]([C:7]([C:8](=[N:9][O:10][S:11](=[O:12])(=[O:13])[O:14][H:28])[S:15][C@:16]1([H:29])[O:17][C@@:18]([C:19]([O:20][H:30])([H:31])[H:32])([H:33])[C@:21]([O:22][H:34])([H:35])[C@@:23]([O:24][H:36])([H:37])[C@:25]1([O:26][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])([H:51])[H:52].[H][O:27][H:53]>>[C@@:16]1([O:27][H:53])([H:29])[O:17][C@@:18]([C:19]([O:20][H:30])([H:31])[H:32])([H:33])[C@:21]([O:22][H:34])([H:35])[C@@:23]([O:24][H:36])([H:37])[C@:25]1([O:26][H:38])[H:39].[H][S:15][C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([S:2][C:1]([H:50])([H:51])[H:52])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])([H:42])[H:43])([H:40])[H:41])=[N:9][O:10][S:11](=[O:12])(=[O:13])[O:14][H:28]