SMIRKS
[H][N:14]([C:12]([N:11]([C:10]([C:9]([C:8]([C@@:6]([C:4]([O:3][C:2]([C:1]([H:61])([H:62])[H:63])([H:59])[H:60])=[O:5])([N:7]([H:46])[H:47])[H:58])([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])[H:51])=[N:13][H:48])[H:49].[N:15]([C:16]1:[N:17]:[C:18]([H:64]):[N:19]:[C:20]2:[C:21]:1:[N:22]:[C:23]([H:65]):[N:24]:2[C@:25]1([H:66])[O:26][C@@:27]([C:28]([O:29][P:30](=[O:31])([O:32][H:67])[O:33][P:34](=[O:35])([O:36][H:68])[O:37][P:38](=[O:39])([O:40][H:69])[O:41][H:70])([H:71])[H:72])([H:73])[C@:42]([O:43][H:74])([H:75])[C@:44]1([O:45][H:76])[H:77])([H:78])[H:79]>>[C:1]([C:2]([O:3][C:4](=[O:5])[C@@:6]([N:7]([H:46])[H:47])([C:8]([C:9]([C:10]([N:11]([C:12](=[N:13][H:48])[N:14]([P:38](=[O:39])([O:40][H:69])[O:41][H:70])[H:49])[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][O:37][P:34]([O:33][P:30]([O:29][C:28]([C@@:27]1([H:73])[O:26][C@:25]([N:24]2:[C:20]3:[N:19]:[C:18]([H:64]):[N:17]:[C:16]([N:15]([H:78])[H:79]):[C:21]:3:[N:22]:[C:23]:2[H:65])([H:66])[C@@:44]([O:45][H:76])([H:77])[C@@:42]1([O:43][H:74])[H:75])([H:71])[H:72])(=[O:31])[O:32][H:67])(=[O:35])[O:36][H:68]
Derived Operators
EVODEX.1-E255 - Reaction Operator E
[#6:10]-[#7:12](-[H:46])-[H].[#15:32]-[#8:35]-[#15:36](=[#8:37])(-[#8:38])-[#8:39]>>[#6:10]-[#7:12](-[#15:36](=[#8:37])(-[#8:38])-[#8:39])-[H:46].[#15:32]-[#8:35]-[H]
EVODEX.1-C886 - Reaction Operator C
([#8:34]-[#15:35].[#6@:39]-[#6@:41]).[H]-[#7:3]>>([H]-[#8:34].[#6@@:41]-[#6@@:39]).[#7:3]-[#15:35]
EVODEX.1-N1108 - Reaction Operator N
([#15:31]-[#8:34]-[#15:35](=[#8:36])(-[#8:37])-[#8:38].[#8:40]-[#6@@:39](-[#6@@:24])(-[H:54])-[#6@:41](-[#6@:22])(-[#8:42])-[H:56]).[H]-[#7:3](-[#6:2])-[H:59]>>([H]-[#8:34]-[#15:31].[#8:42]-[#6@:41](-[#6@:22])(-[H:56])-[#6@@:39](-[#6@@:24])(-[#8:40])-[H:54]).[#6:2]-[#7:3](-[#15:35](=[#8:36])(-[#8:37])-[#8:38])-[H:59]
EVODEX.1-Em562 - Reaction Operator Em
[#15:32]-[#8:35]-[#15:36](=[#8:37])(-[#8:38])-[#8:39].[H]-[#7:9]-[#6:8]>>[H]-[#8:35]-[#15:32].[#6:8]-[#7:9]-[#15:36](=[#8:37])(-[#8:38])-[#8:39]
EVODEX.1-Nm508 - Reaction Operator Nm
[#15:32]-[#8:35]-[#15:36](=[#8:37])(-[#8:38])-[#8:39].[H]-[#7:9]-[#6:8]>>[H]-[#8:35]-[#15:32].[#6:8]-[#7:9]-[#15:36](=[#8:37])(-[#8:38])-[#8:39]
Source Full Reactions
EVODEX.1-R4203
[H][N:14]([C:12]([N:11]([C:10]([C:9]([C:8]([C@@:6]([C:4]([O:3][C:2]([C:1]([H:61])([H:62])[H:63])([H:59])[H:60])=[O:5])([N:7]([H:46])[H:47])[H:58])([H:56])[H:57])([H:54])[H:55])([H:52])[H:53])[H:51])=[N:13][H:48])[H:49].[N:15]([C:16]1:[N:17]:[C:18]([H:64]):[N:19]:[C:20]2:[C:21]:1:[N:22]:[C:23]([H:65]):[N:24]:2[C@:25]1([H:66])[O:26][C@@:27]([C:28]([O:29][P:30](=[O:31])([O:32][H:67])[O:33][P:34](=[O:35])([O:36][H:68])[O:37][P:38](=[O:39])([O:40][H:69])[O:41][H:70])([H:71])[H:72])([H:73])[C@:42]([O:43][H:74])([H:75])[C@:44]1([O:45][H:76])[H:77])([H:78])[H:79]>>[C:1]([C:2]([O:3][C:4](=[O:5])[C@@:6]([N:7]([H:46])[H:47])([C:8]([C:9]([C:10]([N:11]([C:12](=[N:13][H:48])[N:14]([P:38](=[O:39])([O:40][H:69])[O:41][H:70])[H:49])[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][O:37][P:34]([O:33][P:30]([O:29][C:28]([C@@:27]1([H:73])[O:26][C@:25]([N:24]2:[C:20]3:[N:19]:[C:18]([H:64]):[N:17]:[C:16]([N:15]([H:78])[H:79]):[C:21]:3:[N:22]:[C:23]:2[H:65])([H:66])[C@@:44]([O:45][H:76])([H:77])[C@@:42]1([O:43][H:74])[H:75])([H:71])[H:72])(=[O:31])[O:32][H:67])(=[O:35])[O:36][H:68]