SMIRKS
[H][O:7][C:6]1([H:50])[O:5][C@@:4]([C:3]([O:2][C:1]([H:62])([H:63])[H:64])([H:60])[H:61])([H:48])[C@:15]([O:16][H:58])([H:59])[C@@:13]([O:14][H:56])([H:57])[C@@:8]1([N:9]([C:10]([C:11]([H:51])([H:52])[H:53])=[O:12])[H:54])[H:55].[N:17]([C:18]1:[N:19]:[C:20]([H:65]):[N:21]:[C:22]2:[C:23]:1:[N:24]:[C:25]([H:66]):[N:26]:2[C@:27]1([H:67])[O:28][C@@:29]([C:30]([O:31][P:32](=[O:33])([O:34][H:68])[O:35][P:36](=[O:37])([O:38][H:69])[O:39][P:40](=[O:41])([O:42][H:70])[O:43][H:71])([H:72])[H:73])([H:74])[C@:44]([O:45][H:75])([H:76])[C@:46]1([O:47][H:77])[H:78])([H:79])[H:80]>>[C:1]([O:2][C:3]([C@@:4]1([H:48])[O:5][C@@:6]([O:7][P:40](=[O:41])([O:42][H:70])[O:43][H:71])([H:50])[C@:8]([N:9]([C:10]([C:11]([H:51])([H:52])[H:53])=[O:12])[H:54])([H:55])[C@:13]([O:14][H:56])([H:57])[C@@:15]1([O:16][H:58])[H:59])([H:60])[H:61])([H:62])([H:63])[H:64].[H][O:39][P:36]([O:35][P:32]([O:31][C:30]([C@@:29]1([H:74])[O:28][C@:27]([N:26]2:[C:22]3:[N:21]:[C:20]([H:65]):[N:19]:[C:18]([N:17]([H:79])[H:80]):[C:23]:3:[N:24]:[C:25]:2[H:66])([H:67])[C@@:46]([O:47][H:77])([H:78])[C@@:44]1([O:45][H:75])[H:76])([H:72])[H:73])(=[O:33])[O:34][H:68])(=[O:37])[O:38][H:69]
Derived Operators
EVODEX.1-E290 - Reaction Operator E
[#15:16]-[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:23].[#8:32](-[#6:33](-[H:62])(-[#8:34])-[#6@:44])-[H]>>[#15:16]-[#8:19]-[H].[#15:20](=[#8:21])(-[#8:22])(-[#8:23])-[#8:32]-[#6@@:33](-[H:62])(-[#8:34])-[#6@:44]
EVODEX.1-C880 - Reaction Operator C
[H]-[#8:5]-[#6:4]-[#6@@:6]-[#6@:8]-[#6@:10].([#8:32]-[#15:33].[#6@:37]-[#6@:39])>>[#8:5](-[#6@@:4]-[#6@:6]-[#6@@:8]-[#6@@:10])-[#15:33].([H]-[#8:32].[#6@@:39]-[#6@@:37])
EVODEX.1-N1629 - Reaction Operator N
[H]-[#8:7]-[#6:6]1(-[H:50])-[#8:5]-[#6@@:4]-[#6@:15](-[#8:16])(-[H:59])-[#6@@:13](-[#8:14])(-[H:57])-[#6@@:8]-1(-[#7:9])-[H:55].([#15:36]-[#8:39]-[#15:40](=[#8:41])(-[#8:42])-[#8:43].[#8:45]-[#6@@:44](-[#6@@:29])(-[H:76])-[#6@:46](-[#6@:27])(-[#8:47])-[H:78])>>[#8:5]1-[#6@@:4]-[#6@:15](-[#6@@:13](-[#6@@:8](-[#6@:6]-1(-[#8:7]-[#15:40](=[#8:41])(-[#8:42])-[#8:43])-[H:50])(-[#7:9])-[H:55])(-[#8:14])-[H:57])(-[#8:16])-[H:59].([H]-[#8:39]-[#15:36].[#8:47]-[#6@:46](-[#6@:27])(-[H:78])-[#6@@:44](-[#6@@:29])(-[#8:45])-[H:76])
EVODEX.1-Em16 - Reaction Operator Em
[#15:23]-[#8:26]-[#15:27](=[#8:28])(-[#8:29])-[#8:30].[H]-[#8:65]-[#6:66]>>[H]-[#8:26]-[#15:23].[#15:27](=[#8:28])(-[#8:29])(-[#8:30])-[#8:65]-[#6:66]
EVODEX.1-Nm19 - Reaction Operator Nm
[#15:23]-[#8:26]-[#15:27](=[#8:28])(-[#8:29])-[#8:30].[H]-[#8:65]-[#6:66]>>[H]-[#8:26]-[#15:23].[#15:27](=[#8:28])(-[#8:29])(-[#8:30])-[#8:65]-[#6:66]
Source Full Reactions
EVODEX.1-R3952
[H][O:7][C:6]1([H:50])[O:5][C@@:4]([C:3]([O:2][C:1]([H:62])([H:63])[H:64])([H:60])[H:61])([H:48])[C@:15]([O:16][H:58])([H:59])[C@@:13]([O:14][H:56])([H:57])[C@@:8]1([N:9]([C:10]([C:11]([H:51])([H:52])[H:53])=[O:12])[H:54])[H:55].[N:17]([C:18]1:[N:19]:[C:20]([H:65]):[N:21]:[C:22]2:[C:23]:1:[N:24]:[C:25]([H:66]):[N:26]:2[C@:27]1([H:67])[O:28][C@@:29]([C:30]([O:31][P:32](=[O:33])([O:34][H:68])[O:35][P:36](=[O:37])([O:38][H:69])[O:39][P:40](=[O:41])([O:42][H:70])[O:43][H:71])([H:72])[H:73])([H:74])[C@:44]([O:45][H:75])([H:76])[C@:46]1([O:47][H:77])[H:78])([H:79])[H:80]>>[C:1]([O:2][C:3]([C@@:4]1([H:48])[O:5][C@@:6]([O:7][P:40](=[O:41])([O:42][H:70])[O:43][H:71])([H:50])[C@:8]([N:9]([C:10]([C:11]([H:51])([H:52])[H:53])=[O:12])[H:54])([H:55])[C@:13]([O:14][H:56])([H:57])[C@@:15]1([O:16][H:58])[H:59])([H:60])[H:61])([H:62])([H:63])[H:64].[H][O:39][P:36]([O:35][P:32]([O:31][C:30]([C@@:29]1([H:74])[O:28][C@:27]([N:26]2:[C:22]3:[N:21]:[C:20]([H:65]):[N:19]:[C:18]([N:17]([H:79])[H:80]):[C:23]:3:[N:24]:[C:25]:2[H:66])([H:67])[C@@:46]([O:47][H:77])([H:78])[C@@:44]1([O:45][H:75])[H:76])([H:72])[H:73])(=[O:33])[O:34][H:68])(=[O:37])[O:38][H:69]