SMIRKS
[N:1]([C:2]1:[C:3]([H:44]):[C:4]([H:45]):[N:5]([C@:6]2([H:46])[O:7][C@@:8]([C:9]([O:10][P:11](=[O:12])([O:13][H:47])[O:14][P:15](=[O:16])([O:17][H:48])[O:18][P:19](=[O:20])([O:21][H:49])[O:22][H:50])([H:51])[H:52])([H:53])[C@:23]([O:24][H:54])([H:55])[C@:25]2([O:26][H:56])[H:57]):[C:27](=[O:28]):[N:29]:1)([H:58])[H:59].[H][O:41][C@@:40]([C@:38]([C@@:36]([C@@:34]([C:31](=[O:30])[C:32]([O:33][H:60])([H:61])[H:62])([O:35][H:63])[H:73])([O:37][H:64])[H:72])([O:39][H:65])[H:71])([C:42]([O:43][H:67])([H:68])[H:69])[H:70]>>[H][O:18][P:15]([O:14][P:11]([O:10][C:9]([C@@:8]1([H:53])[O:7][C@:6]([N:5]2:[C:4]([H:45]):[C:3]([H:44]):[C:2]([N:1]([H:58])[H:59]):[N:29]:[C:27]:2=[O:28])([H:46])[C@@:25]([O:26][H:56])([H:57])[C@@:23]1([O:24][H:54])[H:55])([H:51])[H:52])(=[O:12])[O:13][H:47])(=[O:16])[O:17][H:48].[P:19](=[O:20])([O:21][H:49])([O:22][H:50])[O:41][C@@:40]([C@:38]([C@@:36]([C@@:34]([C:31](=[O:30])[C:32]([O:33][H:60])([H:61])[H:62])([O:35][H:63])[H:73])([O:37][H:64])[H:72])([O:39][H:65])[H:71])([C:42]([O:43][H:67])([H:68])[H:69])[H:70]
Derived Operators
EVODEX.1-E289 - Reaction Operator E
[#6:76]-[#6@:75](-[#6@@:57])(-[#8:77]-[H])-[H:190].[#15:100]-[#8:103]-[#15:104](=[#8:105])(-[#8:106])-[#8:107]>>[#6:75](-[#6@@:57])(-[#6:76])(-[#8:77]-[#15:104](=[#8:105])(-[#8:106])-[#8:107])-[H:190].[#15:100]-[#8:103]-[H]
EVODEX.1-C22 - Reaction Operator C
([#8:10]-[#15:11].[#6@:15]-[#6@:17]).[H]-[#8:35]>>([H]-[#8:10].[#6@@:17]-[#6@@:15]).[#15:11]-[#8:35]
EVODEX.1-N13 - Reaction Operator N
([#15:16]-[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:23].[#8:29]-[#6@@:28](-[#6@@:13])(-[H:74])-[#6@:30](-[#6@:11])(-[#8:31])-[H:76]).[H]-[#8:60]-[#6@:59]>>([H]-[#8:19]-[#15:16].[#8:31]-[#6@:30](-[#6@:11])(-[H:76])-[#6@@:28](-[#6@@:13])(-[#8:29])-[H:74]).[#15:20](=[#8:21])(-[#8:22])(-[#8:23])-[#8:60]-[#6@:59]
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-R4108
[N:1]([C:2]1:[C:3]([H:44]):[C:4]([H:45]):[N:5]([C@:6]2([H:46])[O:7][C@@:8]([C:9]([O:10][P:11](=[O:12])([O:13][H:47])[O:14][P:15](=[O:16])([O:17][H:48])[O:18][P:19](=[O:20])([O:21][H:49])[O:22][H:50])([H:51])[H:52])([H:53])[C@:23]([O:24][H:54])([H:55])[C@:25]2([O:26][H:56])[H:57]):[C:27](=[O:28]):[N:29]:1)([H:58])[H:59].[H][O:41][C@@:40]([C@:38]([C@@:36]([C@@:34]([C:31](=[O:30])[C:32]([O:33][H:60])([H:61])[H:62])([O:35][H:63])[H:73])([O:37][H:64])[H:72])([O:39][H:65])[H:71])([C:42]([O:43][H:67])([H:68])[H:69])[H:70]>>[H][O:18][P:15]([O:14][P:11]([O:10][C:9]([C@@:8]1([H:53])[O:7][C@:6]([N:5]2:[C:4]([H:45]):[C:3]([H:44]):[C:2]([N:1]([H:58])[H:59]):[N:29]:[C:27]:2=[O:28])([H:46])[C@@:25]([O:26][H:56])([H:57])[C@@:23]1([O:24][H:54])[H:55])([H:51])[H:52])(=[O:12])[O:13][H:47])(=[O:16])[O:17][H:48].[P:19](=[O:20])([O:21][H:49])([O:22][H:50])[O:41][C@@:40]([C@:38]([C@@:36]([C@@:34]([C:31](=[O:30])[C:32]([O:33][H:60])([H:61])[H:62])([O:35][H:63])[H:73])([O:37][H:64])[H:72])([O:39][H:65])[H:71])([C:42]([O:43][H:67])([H:68])[H:69])[H:70]