SMIRKS
[H][O:20][P:18]([O:17][P:14]([O:13][P:10]([O:9][C:8]([C@@:7]1([H:56])[O:6][C@:5]([N:4]2[C:3]([H:47])([H:48])[N:2]([C:1]([H:69])([H:70])[H:71])[C:45]3:[C:38]2:[N:39]([H:66]):[C:40](=[N:41][H:67]):[N:42]([H:68]):[C:43]:3=[O:44])([H:49])[C:24]([O:25][C:26]([N:27]2:[C:28]([H:59]):[N:29]:[C:30]3:[C:31](=[O:32]):[N:33]([H:60]):[C:34](=[N:35][H:61]):[N:36]([H:62]):[C:37]:2:3)([H:63])[H:64])([H:65])[C@:22]1([O:23][H:57])[H:58])([H:54])[H:55])(=[O:11])[O:12][H:50])(=[O:15])[O:16][H:51])(=[O:19])[O:21][H:53]>>[H][O:13][P:10]([O:9][C:8]([C@@:7]1([H:56])[O:6][C@:5]([N:4]2[C:3]([H:47])([H:48])[N:2]([C:1]([H:69])([H:70])[H:71])[C:45]3:[C:38]2:[N:39]([H:66]):[C:40](=[N:41][H:67]):[N:42]([H:68]):[C:43]:3=[O:44])([H:49])[C:24]([O:25][C:26]([N:27]2:[C:28]([H:59]):[N:29]:[C:30]3:[C:31](=[O:32]):[N:33]([H:60]):[C:34](=[N:35][H:61]):[N:36]([H:62]):[C:37]:2:3)([H:63])[H:64])([H:65])[C@:22]1([O:23][H:57])[H:58])([H:54])[H:55])(=[O:11])[O:12][H:50].[H]O[P:14](=[O:15])([O:16][H:51])[O:20][P:18]([O:17][H])(=[O:19])[O:21][H:53]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E399 - Reaction Operator E
[#15:16]-[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:23]-[#15:24]-[#8:26]-[H]>>[#15:16]-[#8:19]-[H].[#15:20](=[#8:21])(-[#8:22])(-[#8:26]-[#15:24]-[#8:23]-[H])-[#8]-[H]
EVODEX.1-C717 - Reaction Operator C
([H]-[#8:20].[#8:17]-[#15:14]-[#8:13])>>[H]-[#8:13].([H]-[#8]-[#15:14]-[#8:20].[#8:17]-[H])
EVODEX.1-N884 - Reaction Operator N
[H]-[#8:20]-[#15:18]-[#8:17]-[#15:14](-[#8:13]-[#15:10])(=[#8:15])-[#8:16]>>[H]-[#8:13]-[#15:10].[H]-[#8]-[#15:14](=[#8:15])(-[#8:16])-[#8:20]-[#15:18]-[#8:17]-[H]
EVODEX.1-Em695 - Reaction Operator Em
[H]-[#8:20]-[#15:18]-[#8:17]-[#15:14](-[#8:13]-[#15:10])(=[#8:15])-[#8:16]>>[H]-[#8:13]-[#15:10].[H]-[#8]-[#15:14](=[#8:15])(-[#8:16])-[#8:20]-[#15:18]-[#8:17]-[H]
EVODEX.1-Cm281 - Reaction Operator Cm
([H]-[#8:20].[#8:17]-[#15:14]-[#8:13])>>[H]-[#8:13].([#8]-[#15:14]-[#8:20].[#8:17]-[H])
EVODEX.1-Nm624 - Reaction Operator Nm
[H]-[#8:20]-[#15:18]-[#8:17]-[#15:14](-[#8:13]-[#15:10])(=[#8:15])-[#8:16]>>[H]-[#8:13]-[#15:10].[H]-[#8]-[#15:14](=[#8:15])(-[#8:16])-[#8:20]-[#15:18]-[#8:17]-[H]
Source Full Reactions
EVODEX.1-R6655
[H][O:20][P:18]([O:17][P:14]([O:13][P:10]([O:9][C:8]([C@@:7]1([H:56])[O:6][C@:5]([N:4]2[C:3]([H:47])([H:48])[N:2]([C:1]([H:69])([H:70])[H:71])[C:45]3:[C:38]2:[N:39]([H:66]):[C:40](=[N:41][H:67]):[N:42]([H:68]):[C:43]:3=[O:44])([H:49])[C:24]([O:25][C:26]([N:27]2:[C:28]([H:59]):[N:29]:[C:30]3:[C:31](=[O:32]):[N:33]([H:60]):[C:34](=[N:35][H:61]):[N:36]([H:62]):[C:37]:2:3)([H:63])[H:64])([H:65])[C@:22]1([O:23][H:57])[H:58])([H:54])[H:55])(=[O:11])[O:12][H:50])(=[O:15])[O:16][H:51])(=[O:19])[O:21][H:53].[H][O:46][H:72]>>[H][O:13][P:10]([O:9][C:8]([C@@:7]1([H:56])[O:6][C@:5]([N:4]2[C:3]([H:47])([H:48])[N:2]([C:1]([H:69])([H:70])[H:71])[C:45]3:[C:38]2:[N:39]([H:66]):[C:40](=[N:41][H:67]):[N:42]([H:68]):[C:43]:3=[O:44])([H:49])[C:24]([O:25][C:26]([N:27]2:[C:28]([H:59]):[N:29]:[C:30]3:[C:31](=[O:32]):[N:33]([H:60]):[C:34](=[N:35][H:61]):[N:36]([H:62]):[C:37]:2:3)([H:63])[H:64])([H:65])[C@:22]1([O:23][H:57])[H:58])([H:54])[H:55])(=[O:11])[O:12][H:50].[H][O:17][P:18](=[O:19])([O:20][P:14](=[O:15])([O:16][H:51])[O:46][H:72])[O:21][H:53]