SMIRKS
[H][S:5][C:4]([C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])([H:46])[H:47])=[N:6][O:7][H:45].[O:8]=[C:9]1:[C:10]([H:53]):[C:11]([H:54]):[N:12]([C@:13]2([H:55])[O:14][C@@:15]([C:16]([O:17][P:18](=[O:19])([O:20][H:56])[O:21][P:22](=[O:23])([O:24][H:57])[O:25][C@@:26]3([H:58])[O:27][C@@:28]([C:29]([O:30][H:59])([H:60])[H:61])([H:62])[C@:31]([O:32][H:63])([H:64])[C@@:33]([O:34][H:65])([H:66])[C@:35]3([O:36][H:67])[H:68])([H:69])[H:70])([H:71])[C@:37]([O:38][H:72])([H:73])[C@:39]2([O:40][H:74])[H:75]):[C:41](=[O:42]):[N:43]:1[H:76]>>[C:1]([C:2]([C:3]([C:4]([S:5][C@@:26]1([H:58])[O:27][C@@:28]([C:29]([O:30][H:59])([H:60])[H:61])([H:62])[C@:31]([O:32][H:63])([H:64])[C@@:33]([O:34][H:65])([H:66])[C@:35]1([O:36][H:67])[H:68])=[N:6][O:7][H:45])([H:46])[H:47])([H:48])[H:49])([H:50])([H:51])[H:52].[H][O:25][P:22]([O:21][P:18]([O:17][C:16]([C@@:15]1([H:71])[O:14][C@:13]([N:12]2:[C:11]([H:54]):[C:10]([H:53]):[C:9](=[O:8]):[N:43]([H:76]):[C:41]:2=[O:42])([H:55])[C@@:39]([O:40][H:74])([H:75])[C@@:37]1([O:38][H:72])[H:73])([H:69])[H:70])(=[O:19])[O:20][H:56])(=[O:23])[O:24][H:57]
Derived Operators
EVODEX.1-E237 - Reaction Operator E
[#16:22](-[#6@:21])-[H].[#15:39]-[#8:42]-[#6@@:43](-[H:84])(-[#8:44])-[#6@:52]>>[#16:22](-[#6@:21])-[#6@:43](-[H:84])(-[#8:44])-[#6@:52].[#15:39]-[#8:42]-[H]
EVODEX.1-C381 - Reaction Operator C
[H]-[#16:48].([#8:67]-[#6:68].[#6@:77]-[#6@:79])>>[#16:48]-[#6:68].([H]-[#8:67].[#6@@:79]-[#6@@:77])
EVODEX.1-N1092 - Reaction Operator N
[H]-[#16:5]-[#6:4].([#15:22]-[#8:25]-[#6@@:26](-[H:58])(-[#8:27])-[#6@:35].[#8:38]-[#6@@:37](-[#6@@:15])(-[H:73])-[#6@:39](-[#6@:13])(-[#8:40])-[H:75])>>[#6:4]-[#16:5]-[#6@@:26](-[H:58])(-[#8:27])-[#6@:35].([H]-[#8:25]-[#15:22].[#8:40]-[#6@:39](-[#6@:13])(-[H:75])-[#6@@:37](-[#6@@:15])(-[#8:38])-[H:73])
EVODEX.1-Em496 - Reaction Operator Em
[H]-[#16:22]-[#6:21].[#15:39]-[#8:42]-[#6:43](-[#8:44])-[#6:52]>>[#6:21]-[#16:22]-[#6:43](-[#8:44])-[#6:52].[H]-[#8:42]-[#15:39]
EVODEX.1-Nm447 - Reaction Operator Nm
[H]-[#16:22]-[#6:21].[#15:39]-[#8:42]-[#6:43](-[#8:44])-[#6:52]>>[#6:21]-[#16:22]-[#6:43](-[#8:44])-[#6:52].[H]-[#8:42]-[#15:39]
Source Full Reactions
EVODEX.1-R3055
[H][S:5][C:4]([C:3]([C:2]([C:1]([H:50])([H:51])[H:52])([H:48])[H:49])([H:46])[H:47])=[N:6][O:7][H:45].[O:8]=[C:9]1:[C:10]([H:53]):[C:11]([H:54]):[N:12]([C@:13]2([H:55])[O:14][C@@:15]([C:16]([O:17][P:18](=[O:19])([O:20][H:56])[O:21][P:22](=[O:23])([O:24][H:57])[O:25][C@@:26]3([H:58])[O:27][C@@:28]([C:29]([O:30][H:59])([H:60])[H:61])([H:62])[C@:31]([O:32][H:63])([H:64])[C@@:33]([O:34][H:65])([H:66])[C@:35]3([O:36][H:67])[H:68])([H:69])[H:70])([H:71])[C@:37]([O:38][H:72])([H:73])[C@:39]2([O:40][H:74])[H:75]):[C:41](=[O:42]):[N:43]:1[H:76]>>[C:1]([C:2]([C:3]([C:4]([S:5][C@@:26]1([H:58])[O:27][C@@:28]([C:29]([O:30][H:59])([H:60])[H:61])([H:62])[C@:31]([O:32][H:63])([H:64])[C@@:33]([O:34][H:65])([H:66])[C@:35]1([O:36][H:67])[H:68])=[N:6][O:7][H:45])([H:46])[H:47])([H:48])[H:49])([H:50])([H:51])[H:52].[H][O:25][P:22]([O:21][P:18]([O:17][C:16]([C@@:15]1([H:71])[O:14][C@:13]([N:12]2:[C:11]([H:54]):[C:10]([H:53]):[C:9](=[O:8]):[N:43]([H:76]):[C:41]:2=[O:42])([H:55])[C@@:39]([O:40][H:74])([H:75])[C@@:37]1([O:38][H:72])[H:73])([H:69])[H:70])(=[O:19])[O:20][H:56])(=[O:23])[O:24][H:57]