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EVODEX.1-N1250

SMIRKS

Operator SMIRKS Rendering

[H]-[#8]-[#6](-[H])(-[H])-[#6@@]1(-[H])-[#8]-[#6@@](-[H])(-[#8]-[#6@@:7](-[H:48])(-[#6@@:6])-[#6@@:20])-[#6@](-[H])(-[#8]-[H])-[#6@@](-[H])(-[#8]-[H])-[#6@@]-1(-[H])-[#8]-[H]>>[H]-[#8]-[#6@:7](-[H:48])(-[#6@@:6])-[#6@@:20]

Source Partial Reactions

EVODEX.1-P4326

Partial Reaction Rendering

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@:3]([C:2]#[N:1])([C:16]2:[C:17]([H:34]):[C:18]([H:35]):[C:19]([H:36]):[C:20]([H:37]):[C:21]:2[H:38])[H:39])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H]>>[H]O[C:3]([C:2]#[N:1])([C:16]1:[C:17]([H:34]):[C:18]([H:35]):[C:19]([H:36]):[C:20]([H:37]):[C:21]:1[H:38])[H:39]

EVODEX.1-P4448

Partial Reaction Rendering

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@:12]2([H:71])[C@:9]([C:10]([O:11][H:56])([H:57])[H:58])([H:59])[O:8][C@:7]([O:6][C@@:5]3([H:76])[C:4]([H:53])([H:54])[C:3]([H:51])([H:52])[C@@:2]4([C:1]([H:102])([H:103])[H:104])[C@@:30]([H:79])([C:29]3([H:77])[H:78])[C:31]([H:80])([H:81])[C:32]([H:82])([H:83])[C@:33]3([H:84])[C:34]4([H:85])[C:35]([H:86])([H:87])[C:36]([H:88])([H:89])[C@:37]4([C:38]([H:90])([H:91])[H:92])[C@:39]([C:40]5=[C:41]([H:93])[C:42](=[O:43])[O:44][C:45]5([H:94])[H:95])([H:96])[C:46]([H:97])([H:98])[C:47]([H:99])([H:100])[C@@:48]34[O:49][H:101])([H:55])[C@@:27]([O:28][H:74])([H:75])[C@:25]2([O:26][H:72])[H:73])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H]>>[H]O[C@@:12]1([H:71])[C@:9]([C:10]([O:11][H:56])([H:57])[H:58])([H:59])[O:8][C@:7]([O:6][C@@:5]2([H:76])[C:4]([H:53])([H:54])[C:3]([H:51])([H:52])[C@@:2]3([C:1]([H:102])([H:103])[H:104])[C@@:30]([H:79])([C:29]2([H:77])[H:78])[C:31]([H:80])([H:81])[C:32]([H:82])([H:83])[C@:33]2([H:84])[C:34]3([H:85])[C:35]([H:86])([H:87])[C:36]([H:88])([H:89])[C@:37]3([C:38]([H:90])([H:91])[H:92])[C@:39]([C:40]4=[C:41]([H:93])[C:42](=[O:43])[O:44][C:45]4([H:94])[H:95])([H:96])[C:46]([H:97])([H:98])[C:47]([H:99])([H:100])[C@@:48]23[O:49][H:101])([H:55])[C@@:27]([O:28][H:74])([H:75])[C@:25]1([O:26][H:72])[H:73]

EVODEX.1-P4522

Partial Reaction Rendering

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@@:7]2([H:48])[C@@:6]([O:5][C@:4]3([H:57])[O:3][C@:2]([C:1]([H:64])([H:65])[H:66])([H:35])[C@:32]([O:33][H:62])([H:63])[C@:30]([O:31][H:60])([H:61])[C@@:28]3([O:29][H:58])[H:59])([H:36])[C@:26]([O:27][H:55])([H:56])[C:24]([O:25][H:53])([H:54])[O:23][C@@:20]2([C:21]([O:22][H:49])([H:50])[H:51])[H:52])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H]>>[H]O[C@:7]1([H:48])[C@@:6]([O:5][C@:4]2([H:57])[O:3][C@:2]([C:1]([H:64])([H:65])[H:66])([H:35])[C@:32]([O:33][H:62])([H:63])[C@:30]([O:31][H:60])([H:61])[C@@:28]2([O:29][H:58])[H:59])([H:36])[C@:26]([O:27][H:55])([H:56])[C:24]([O:25][H:53])([H:54])[O:23][C@@:20]1([C:21]([O:22][H:49])([H:50])[H:51])[H:52]