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EVODEX.1-P3991

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:10][C:11]([C@:12]([O:13][H:28])([C:14]([O: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][O:10][C:11]([C@:12]([O:13][H:28])([C:14]([O: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]

Derived Operators

EVODEX.1-F8 - Elemental Balance

O-1
C-8
H-14

EVODEX.1-M92 - Mass Difference

-126.10452

EVODEX.1-E334 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#8])-[#8:10]-[#6:11])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])(-[H])-[H]>>[#8:10](-[#6:11])-[H]

EVODEX.1-C286 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:10]>>[H]-[#8:10]

EVODEX.1-N321 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:10]-[#6:11]>>[H]-[#8:10]-[#6:11]

EVODEX.1-Em10 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6]-[#6](=[#8])-[#8:20]-[#6:21]>>[H]-[#8:20]-[#6:21]

EVODEX.1-Cm8 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#8:2]>>[H]-[#8:2]

EVODEX.1-Nm9 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6]-[#6](=[#8])-[#8:20]-[#6:21]>>[H]-[#8:20]-[#6:21]

Source Full Reactions

EVODEX.1-R4839

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8](=[O:9])[O:10][C:11]([C@:12]([O:13][H:28])([C:14]([O: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:53])[H:54])([H:55])[H:56])([H:57])([H:58])[H:59].[H][O:27][H:60]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8](=[O:9])[O:27][H:60])([H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])[H:56])([H:57])([H:58])[H:59].[H][O:10][C:11]([C@:12]([O:13][H:28])([C:14]([O: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]