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EVODEX.1-P3988

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([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)[O:20][C@:21]([C:22]([O:23][H:38])([H:39])[H:40])([C:24]([O:25][C:26]1([H:41])[O:27][C@@:28]([C:29]([O:30][H:42])([H:43])[H:44])([H:45])[C@@:31]([O:32][H:46])([H:47])[C@@:33]([O:34][H:48])([H:49])[C@:35]1([O:36][H:50])[H:51])([H:52])[H:53])[H:54])C([H])([H])C([H])=C([H])C([H])([H])C([H])([H])[H]>>[H][O:20][C@:21]([C:22]([O:23][H:38])([H:39])[H:40])([C:24]([O:25][C:26]1([H:41])[O:27][C@@:28]([C:29]([O:30][H:42])([H:43])[H:44])([H:45])[C@@:31]([O:32][H:46])([H:47])[C@@:33]([O:34][H:48])([H:49])[C@:35]1([O:36][H:50])[H:51])([H:52])[H:53])[H:54]

Derived Operators

EVODEX.1-F127 - Elemental Balance

O-1
C-18
H-28

EVODEX.1-M243 - Mass Difference

-260.21414

EVODEX.1-E768 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:23]-[#8:24]-[#6](=[#8])-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](-[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]>>[#6:23]-[#8:24]-[H]

EVODEX.1-C314 - 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](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:24])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H]>>[H]-[#8:24]

EVODEX.1-N364 - 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](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](=[#8])-[#8:24]-[#6:23])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H]>>[H]-[#8:24]-[#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-R4836

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](=[O:19])[O:20][C@:21]([C:22]([O:23][H:38])([H:39])[H:40])([C:24]([O:25][C:26]1([H:41])[O:27][C@@:28]([C:29]([O:30][H:42])([H:43])[H:44])([H:45])[C@@:31]([O:32][H:46])([H:47])[C@@:33]([O:34][H:48])([H:49])[C@:35]1([O:36][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:71])[H:72])[H:73])[H:74])([H:75])[H:76])[H:77])[H:78])([H:79])[H:80])([H:81])([H:82])[H:83].[H][O:37][H:84]>>[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](=[O:19])[O:37][H:84])([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:71])[H:72])[H:73])[H:74])([H:75])[H:76])[H:77])[H:78])([H:79])[H:80])([H:81])([H:82])[H:83].[H][O:20][C@:21]([C:22]([O:23][H:38])([H:39])[H:40])([C:24]([O:25][C:26]1([H:41])[O:27][C@@:28]([C:29]([O:30][H:42])([H:43])[H:44])([H:45])[C@@:31]([O:32][H:46])([H:47])[C@@:33]([O:34][H:48])([H:49])[C@:35]1([O:36][H:50])[H:51])([H:52])[H:53])[H:54]