SMIRKS
[H][N:1]([C:2]([C:3]([N:4]([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])[H:55].[N:5]([C:6]1:[N:7]:[C:8]([H:57]):[N:9]:[C:10]2:[C:11]:1:[N:12]:[C:13]([H:58]):[N:14]:2[C@:15]1([H:59])[O:16][C@@:17]([C:18]([O:19][P:20](=[O:21])([O:22][H:60])[O:23][P:24](=[O:25])([O:26][H:61])[O:27][P:28](=[O:29])([O:30][H:62])[O:31][H:63])([H:64])[H:65])([H:66])[C@:32]([O:33][H:67])([H:68])[C@:34]1([O:35][H:69])[H:70])([H:71])[H:72].[O:36]=[C:37]([O:38][H:73])[C:39]([C:40]([O:41][H:74])([C:42]([C:43](=[O:44])[O:45][H:75])([H:76])[H:77])[C:46](=[O:47])[O:48][H:78])([H:79])[H:80]>>[N:5]([C:6]1:[N:7]:[C:8]([H:57]):[N:9]:[C:10]2:[C:11]:1:[N:12]:[C:13]([H:58]):[N:14]:2[C@:15]1([H:59])[O:16][C@@:17]([C:18]([O:19][P:20](=[O:21])([O:22][H:60])[O:38][H:73])([H:64])[H:65])([H:66])[C@:32]([O:33][H:67])([H:68])[C@:34]1([O:35][H:69])[H:70])([H:71])[H:72].[N:1]([C:2]([C:3]([N:4]([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([C:37](=[O:36])[C:39]([C:40]([O:41][H:74])([C:42]([C:43](=[O:44])[O:45][H:75])([H:76])[H:77])[C:46](=[O:47])[O:48][H:78])([H:79])[H:80])[H:55].[H][O:23][P:24](=[O:25])([O:26][H:61])[O:27][P:28](=[O:29])([O:30][H:62])[O:31][H:63]
Derived Operators
EVODEX.1-E139 - Reaction Operator E
[#7:121](-[#6@@:120])(-[H:267])-[H].[#8:178]-[#15:179](=[#8:180])(-[#8:181])-[#8:182]-[#15:183].[#8:195]=[#6:196](-[#8:197]-[H:374])-[#6:198]>>[#7:121](-[#6@@:120])(-[#6:196](=[#8:195])-[#6:198])-[H:267].[#8:178]-[#15:179](=[#8:180])(-[#8:181])-[#8:197]-[H:374].[#8:182](-[#15:183])-[H]
EVODEX.1-C1157 - Reaction Operator C
[H]-[#7:1].[#15:20]-[#8:23].[#6:37]-[#8:38]>>[#15:20]-[#8:38].[#7:1]-[#6:37].[H]-[#8:23]
EVODEX.1-N1432 - Reaction Operator N
[H]-[#7:1](-[#6:2])-[H:55].[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:23]-[#15:24].[#8:36]=[#6:37](-[#8:38]-[H:73])-[#6:39]>>[#8:19]-[#15:20](=[#8:21])(-[#8:22])-[#8:38]-[H:73].[#7:1](-[#6:2])(-[#6:37](=[#8:36])-[#6:39])-[H:55].[H]-[#8:23]-[#15:24]
EVODEX.1-Em45 - Reaction Operator Em
[#6:45]-[#6:47](=[#8:48])-[#8:49].[H]-[#7:57]-[#6:56].[#8:79]-[#15:80](=[#8:81])(-[#8:82])-[#8:83]-[#15:84]>>[#6:45]-[#6:47](=[#8:48])-[#7:57]-[#6:56].[#8:49]-[#15:80](-[#8:79])(=[#8:81])-[#8:82].[H]-[#8:83]-[#15:84]
EVODEX.1-Cm71 - Reaction Operator Cm
[#6:47]-[#8:49].[H]-[#7:57].[#15:80]-[#8:83]>>[#6:47]-[#7:57].[#8:49]-[#15:80].[H]-[#8:83]
EVODEX.1-Nm50 - Reaction Operator Nm
[#6:45]-[#6:47](=[#8:48])-[#8:49].[H]-[#7:57]-[#6:56].[#8:79]-[#15:80](=[#8:81])(-[#8:82])-[#8:83]-[#15:84]>>[#6:45]-[#6:47](=[#8:48])-[#7:57]-[#6:56].[#8:49]-[#15:80](-[#8:79])(=[#8:81])-[#8:82].[H]-[#8:83]-[#15:84]
Source Full Reactions
EVODEX.1-R7889
[H][N:1]([C:2]([C:3]([N:4]([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])[H:55].[N:5]([C:6]1:[N:7]:[C:8]([H:57]):[N:9]:[C:10]2:[C:11]:1:[N:12]:[C:13]([H:58]):[N:14]:2[C@:15]1([H:59])[O:16][C@@:17]([C:18]([O:19][P:20](=[O:21])([O:22][H:60])[O:23][P:24](=[O:25])([O:26][H:61])[O:27][P:28](=[O:29])([O:30][H:62])[O:31][H:63])([H:64])[H:65])([H:66])[C@:32]([O:33][H:67])([H:68])[C@:34]1([O:35][H:69])[H:70])([H:71])[H:72].[O:36]=[C:37]([O:38][H:73])[C:39]([C:40]([O:41][H:74])([C:42]([C:43](=[O:44])[O:45][H:75])([H:76])[H:77])[C:46](=[O:47])[O:48][H:78])([H:79])[H:80]>>[N:5]([C:6]1:[N:7]:[C:8]([H:57]):[N:9]:[C:10]2:[C:11]:1:[N:12]:[C:13]([H:58]):[N:14]:2[C@:15]1([H:59])[O:16][C@@:17]([C:18]([O:19][P:20](=[O:21])([O:22][H:60])[O:38][H:73])([H:64])[H:65])([H:66])[C@:32]([O:33][H:67])([H:68])[C@:34]1([O:35][H:69])[H:70])([H:71])[H:72].[N:1]([C:2]([C:3]([N:4]([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([C:37](=[O:36])[C:39]([C:40]([O:41][H:74])([C:42]([C:43](=[O:44])[O:45][H:75])([H:76])[H:77])[C:46](=[O:47])[O:48][H:78])([H:79])[H:80])[H:55].[H][O:23][P:24](=[O:25])([O:26][H:61])[O:27][P:28](=[O:29])([O:30][H:62])[O:31][H:63]