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EVODEX.1-P4663

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]N([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)[N:10]([C:11]1:[C:12]([H:29]):[C:13]([H:30]):[C:14]2:[C:15]([C:16]([C:17]([N:18]([H:31])[H:32])=[O:19])([H:33])[H:34]):[C:20]([H:35]):[C:21](=[O:22]):[O:23]:[C:24]:2:[C:25]:1[H:36])[H:37])N([H])[H]>>[H][N:10]([C:11]1:[C:12]([H:29]):[C:13]([H:30]):[C:14]2:[C:15]([C:16]([C:17]([N:18]([H:31])[H:32])=[O:19])([H:33])[H:34]):[C:20]([H:35]):[C:21](=[O:22]):[O:23]:[C:24]:2:[C:25]:1[H:36])[H:37]

Derived Operators

EVODEX.1-F267 - Elemental Balance

O-1
C-6
N-2
H-12

EVODEX.1-M84 - Mass Difference

-128.09506000000002

EVODEX.1-E1008 - Reaction Operator E

Reaction Operator E SMIRKS

[#7:37](-[#6@:28])(-[#6](=[#8])-[#6@@](-[#7](-[H])-[H])(-[#6](-[#6](-[#6](-[#6](-[#7](-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])-[H])-[H:78]>>[#7:37](-[#6@:28])(-[H:78])-[H]

EVODEX.1-C566 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N719 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6@@](-[H])(-[#6](=[#8])-[#7:6](-[#6@@:5])-[H:46])-[#7](-[H])-[H]>>[H]-[#7:6](-[#6@@:5])-[H:46]

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-R5483

Full Reaction Rendering

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