EVODEX.1-P4404

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([O:2][C@:3]1([H:29])[O:4][C@@:5]([C:6]([O:7][C@:8]2([H:30])[O:9][C@@:10]([C:11]([O:12][H:31])([H:32])[H:33])([H:34])[C@:13]([O:14][H:35])([H:36])[C@@:15]([O:16][H:37])([H:38])[C@:17]2([N:18]([C:19]([C:20]([H:39])([H:40])[H:41])=[O:21])[H:42])[H:43])([H:44])[H:45])([H:46])[C@:22]([O:23][H:47])([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])([H:54])[H:55].[H][O:28][H:56]>>[C:1]([O:2][C@:3]1([H:29])[O:4][C@@:5]([C:6]([O:28][H:56])([H:44])[H:45])([H:46])[C@:22]([O:23][H:47])([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])([H:54])[H:55].[H][O:7][C:8]1([H:30])[O:9][C@@:10]([C:11]([O:12][H:31])([H:32])[H:33])([H:34])[C@:13]([O:14][H:35])([H:36])[C@@:15]([O:16][H:37])([H:38])[C@:17]1([N:18]([C:19]([C:20]([H:39])([H:40])[H:41])=[O:21])[H:42])[H:43]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E216 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:4]-[#6:5](-[#8:6]-[#6@:7](-[H:19])(-[#8:8])-[#6@:16])(-[H:30])-[H:31].[#8:18](-[H:41])-[H]>>[#6:4]-[#6:5](-[#8:18]-[H:41])(-[H:30])-[H:31].[#8:6](-[#6:7](-[H:19])(-[#8:8])-[#6@:16])-[H]

EVODEX.1-C37 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:19]-[#8:20]-[#6@@:21].[H]-[#8:35]>>[#6:19]-[#8:35].[H]-[#8:20]-[#6:21]

EVODEX.1-N680 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:18]-[#6:19](-[#8:20]-[#6@@:21](-[H:37])(-[#8:22])-[#6@:30])(-[H:48])-[H:49].[H]-[#8:35]-[H:87]>>[#6:18]-[#6:19](-[#8:35]-[H:87])(-[H:48])-[H:49].[H]-[#8:20]-[#6:21](-[H:37])(-[#8:22])-[#6@:30]

EVODEX.1-Em117 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2]-[#8:3]-[#6:4].[H]-[#8:13]>>[#6:1]-[#6:2]-[#8:13].[H]-[#8:3]-[#6:4]

EVODEX.1-Cm2 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:5]-[#8:6].[H]-[#8:44]>>[#6:5]-[#8:44].[H]-[#8:6]

EVODEX.1-Nm151 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2]-[#8:3]-[#6:4].[H]-[#8:13]>>[#6:1]-[#6:2]-[#8:13].[H]-[#8:3]-[#6:4]

Source Full Reactions

EVODEX.1-R5242

Full Reaction Rendering

[C:1]([O:2][C@:3]1([H:29])[O:4][C@@:5]([C:6]([O:7][C@:8]2([H:30])[O:9][C@@:10]([C:11]([O:12][H:31])([H:32])[H:33])([H:34])[C@:13]([O:14][H:35])([H:36])[C@@:15]([O:16][H:37])([H:38])[C@:17]2([N:18]([C:19]([C:20]([H:39])([H:40])[H:41])=[O:21])[H:42])[H:43])([H:44])[H:45])([H:46])[C@:22]([O:23][H:47])([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])([H:54])[H:55].[H][O:28][H:56]>>[C:1]([O:2][C@:3]1([H:29])[O:4][C@@:5]([C:6]([O:28][H:56])([H:44])[H:45])([H:46])[C@:22]([O:23][H:47])([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])([H:54])[H:55].[H][O:7][C:8]1([H:30])[O:9][C@@:10]([C:11]([O:12][H:31])([H:32])[H:33])([H:34])[C@:13]([O:14][H:35])([H:36])[C@@:15]([O:16][H:37])([H:38])[C@:17]1([N:18]([C:19]([C:20]([H:39])([H:40])[H:41])=[O:21])[H:42])[H:43]