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EVODEX.1-P3964

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]C(=C([H])C([H])([H])C([H])=C([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:22][C:23]1:[C:24]([H:35]):[C:25]([H:36]):[C:26]2:[C:27]([H:37]):[C:28]([H:38]):[C:29](=[O:30]):[O:31]:[C:32]:2:[C:33]:1[H:39])C([H])([H])C([H])=C([H])C([H])([H])C([H])=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]>>[H][O:22][C:23]1:[C:24]([H:35]):[C:25]([H:36]):[C:26]2:[C:27]([H:37]):[C:28]([H:38]):[C:29](=[O:30]):[O:31]:[C:32]:2:[C:33]:1[H:39]

Derived Operators

EVODEX.1-F121 - Elemental Balance

O-1
C-20
H-30

EVODEX.1-M240 - Mass Difference

-286.2298

EVODEX.1-E747 - Reaction Operator E

Reaction Operator E SMIRKS

[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](-[#6](-[#6](=[#8])-[#8:22]-[#6:23])(-[H])-[H])(-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])(-[H])-[H]>>[#8:22](-[#6:23])-[H]

EVODEX.1-C507 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6](=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:22])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H]>>[H]-[#8:22]

EVODEX.1-N632 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6](=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:22]-[#6:23])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H]>>[H]-[#8:22]-[#6:23]

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-R4815

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](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:22][C:23]1:[C:24]([H:35]):[C:25]([H:36]):[C:26]2:[C:27]([H:37]):[C:28]([H:38]):[C:29](=[O:30]):[O:31]:[C:32]:2:[C:33]:1[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:60])[H:61])([H:62])[H:63])([H:64])[H:65])([H:66])[H:67])([H:68])([H:69])[H:70].[H][O:34][H:71]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:34][H:71])([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:60])[H:61])([H:62])[H:63])([H:64])[H:65])([H:66])[H:67])([H:68])([H:69])[H:70].[H][O:22][C:23]1:[C:24]([H:35]):[C:25]([H:36]):[C:26]2:[C:27]([H:37]):[C:28]([H:38]):[C:29](=[O:30]):[O:31]:[C:32]:2:[C:33]:1[H:39]