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EVODEX.1-P5517

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]1:[C:18]([H:26]):[N:19]:[C:20]([H:27]):[N:21]:1[H:28])([H:29])[H:30])([C:22](=[O:23])[O:24][H:31])[H:32])[H:33]>>[H][N:14]([C@@:15]([C:16]([C:17]1:[C:18]([H:26]):[N:19]:[C:20]([H:27]):[N:21]:1[H:28])([H:29])[H:30])([C:22](=[O:23])[O:24][H:31])[H:32])[H:33]

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-R6256

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]1:[C:18]([H:26]):[N:19]:[C:20]([H:27]):[N:21]:1[H:28])([H:29])[H:30])([C:22](=[O:23])[O:24][H:31])[H:32])[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][O:25][H:57]>>[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:25][H:57])([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][N:14]([C@@:15]([C:16]([C:17]1:[C:18]([H:26]):[N:19]:[C:20]([H:27]):[N:21]:1[H:28])([H:29])[H:30])([C:22](=[O:23])[O:24][H:31])[H:32])[H:33]