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EVODEX.1-P5519

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([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[N:14]([C@@:15]([C:16]([C:17]([C:18]([H:24])([H:25])[H:26])([C:19]([H:27])([H:28])[H:29])[H:30])([H:31])[H:32])([C:20](=[O:21])[O:22][H:33])[H:34])[H:35]>>[H][N:14]([C@@:15]([C:16]([C:17]([C:18]([H:24])([H:25])[H:26])([C:19]([H:27])([H:28])[H:29])[H:30])([H:31])[H:32])([C:20](=[O:21])[O:22][H:33])[H:34])[H:35]

Derived Operators

EVODEX.1-F22 - Elemental Balance

O-1
C-12
H-22

EVODEX.1-M94 - Mass Difference

-182.16716

EVODEX.1-E461 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#8])-[#7:14](-[#6:15])-[H:29])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])(-[H])-[H]>>[#7:14](-[#6:15])(-[H:29])-[H]

EVODEX.1-C687 - 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](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7:21]>>[H]-[#7:21]

EVODEX.1-N848 - 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](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#7:21](-[#6@:18])-[H:63]>>[H]-[#7:21](-[#6@:18])-[H:63]

EVODEX.1-Em1 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6]-[#6](=[#8])-[#7:7]-[#6:8]>>[H]-[#7:7]-[#6:8]

EVODEX.1-Cm1 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#7:7]>>[H]-[#7:7]

EVODEX.1-Nm1 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6]-[#6](=[#8])-[#7:7]-[#6:8]>>[H]-[#7:7]-[#6:8]

Source Full Reactions

EVODEX.1-R6257

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12](=[O:13])[N:14]([C@@:15]([C:16]([C:17]([C:18]([H:24])([H:25])[H:26])([C:19]([H:27])([H:28])[H:29])[H:30])([H:31])[H:32])([C:20](=[O:21])[O:22][H:33])[H:34])[H:35])([H:36])[H:37])([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][O:23][H:59]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12](=[O:13])[O:23][H:59])([H:36])[H:37])([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][N:14]([C@@:15]([C:16]([C:17]([C:18]([H:24])([H:25])[H:26])([C:19]([H:27])([H:28])[H:29])[H:30])([H:31])[H:32])([C:20](=[O:21])[O:22][H:33])[H:34])[H:35]