EVODEX.1-P4369

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:2]=[C:3]([C@:4]([O:5][H:23])([C@@:6]([O:7][H:24])([C@:8]([O:9][H:25])([C@:10]([O:11][H:26])([C:12]([O:13][C@:14]1([H:27])[O:15][C:16]([H:28])([H:29])[C@:17]([O:18][H:30])([H:31])[C@@:19]([O:20][H:32])([H:33])[C@:21]1([O:22][H:34])[H:35])([H:36])[H:37])[H:38])[H:39])[H:40])[H:41])[H:42].[H][O:1][H:43]>>[H][O:13][C:14]1([H:27])[O:15][C:16]([H:28])([H:29])[C@:17]([O:18][H:30])([H:31])[C@@:19]([O:20][H:32])([H:33])[C@:21]1([O:22][H:34])[H:35].[O:1]([C:12]([C@:10]([C@:8]([C@@:6]([C@:4]([C:3](=[O:2])[H:42])([O:5][H:23])[H:41])([O:7][H:24])[H:40])([O:9][H:25])[H:39])([O:11][H:26])[H:38])([H:36])[H:37])[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-R5208

Full Reaction Rendering

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