EVODEX Logo

EVODEX.1-C1218

SMIRKS

Operator SMIRKS Rendering

([H]-[#7:19]-[#6@:20]-[#6@:21].[#6@@:3]-[#6@@:28]).[H]-[#8]-[#6](=[#8])-[#6@@](-[H])(-[#7](-[H])-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#16](-[#6](-[H])(-[H])-[#6@@]1(-[H])-[#8]-[#6@@](-[H])(-[#7]2:[#6](-[H]):[#7]:[#6]3:[#6](-[#7](-[H])-[H]):[#7]:[#6](-[H]):[#7]:[#6]:2:3)-[#6@](-[H])(-[#8]-[H])-[#6@]-1(-[H])-[#8]-[H])-[#6:29]>>([#7:19](-[#6:29])-[#6@@:20]-[#6@@:21].[#6@:3]-[#6@:28])

Source Partial Reactions

EVODEX.1-P1324

Partial Reaction Rendering

[H][N:19]1[C:18]2:[C:11](:[C:12]([H:64]):[C:13]([H:65]):[C:14]([O:15][C:16]([H:66])([H:67])[H:68]):[C:17]:2[H:69])[C@@:10]23[C:9]([H:62])([H:63])[C:8]([H:60])([H:61])[N:7]4[C:6]([H:58])([H:59])[C:5]([H:57])=[C:4]([H:56])[C@@:3]([C:2]([C:1]([H:81])([H:82])[H:83])([H:79])[H:80])([C:27]([H:76])([H:77])[C@:21]([O:22][H:72])([C:23](=[O:24])[O:25][C:26]([H:73])([H:74])[H:75])[C@@:20]21[H:71])[C@:28]43[H:78].[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])C([H])([H])[S+](C([H])([H])[C@@]1([H])O[C@@]([H])(N2:C([H]):N:C3:C(N([H])[H]):N:C([H]):N:C:3:2)[C@]([H])(O[H])[C@]1([H])O[H])[C:29]([H:104])([H:105])[H:106]>>[C:1]([C:2]([C@:3]12[C:4]([H:56])=[C:5]([H:57])[C:6]([H:58])([H:59])[N:7]3[C:8]([H:60])([H:61])[C:9]([H:62])([H:63])[C@@:10]4([C:11]5:[C:12]([H:64]):[C:13]([H:65]):[C:14]([O:15][C:16]([H:66])([H:67])[H:68]):[C:17]([H:69]):[C:18]:5[N:19]([C:29]([H:104])([H:105])[H:106])[C@@:20]4([H:71])[C@@:21]([O:22][H:72])([C:23](=[O:24])[O:25][C:26]([H:73])([H:74])[H:75])[C:27]1([H:76])[H:77])[C@:28]23[H:78])([H:79])[H:80])([H:81])([H:82])[H:83]