SMIRKS
[N:11]([C:12]1:[N:13]:[C:14]([H:55]):[N:15]:[C:16]2:[C:17]:1:[N:18]:[C:19]([H:56]):[N:20]:2[C@:21]1([H:57])[O:22][C@@:23]([C:24]([O:25][P:26](=[O:27])([O:28][H:58])[O:29][P:30](=[O:31])([O:32][H:59])[O:33][P:34](=[O:35])([O:36][H:60])[O:37][H:61])([H:62])[H:63])([H:64])[C@:38]([O:39][H:65])([H:66])[C@:40]1([O:41][H:67])[H:68])([H:69])[H:70].[H][N:1]([C:2]([C:3]([C:4]([C:5]([C@:6]([N:7]([H:71])[H:72])([C:8](=[O:9])[O:10][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])[H:83].[O:42]=[C:43]([O:44][H:85])[C:45]([C:46]1:[C:47]([H:86]):[N:48]([H:87]):[C:49]2:[C:50]([H:88]):[C:51]([H:89]):[C:52]([H:90]):[C:53]([H:91]):[C:54]:1:2)([H:92])[H:93]>>[N:11]([C:12]1:[N:13]:[C:14]([H:55]):[N:15]:[C:16]2:[C:17]:1:[N:18]:[C:19]([H:56]):[N:20]:2[C@:21]1([H:57])[O:22][C@@:23]([C:24]([O:25][P:26](=[O:27])([O:28][H:58])[O:29][P:30](=[O:31])([O:32][H:59])[O:44][H:85])([H:62])[H:63])([H:64])[C@:38]([O:39][H:65])([H:66])[C@:40]1([O:41][H:67])[H:68])([H:69])[H:70].[N:1]([C:2]([C:3]([C:4]([C:5]([C@:6]([N:7]([H:71])[H:72])([C:8](=[O:9])[O:10][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([C:43](=[O:42])[C:45]([C:46]1:[C:47]([H:86]):[N:48]([H:87]):[C:49]2:[C:50]([H:88]):[C:51]([H:89]):[C:52]([H:90]):[C:53]([H:91]):[C:54]:1:2)([H:92])[H:93])[H:83].[H][O:33][P:34](=[O:35])([O:36][H:60])[O:37][H:61]
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-R7684
[N:11]([C:12]1:[N:13]:[C:14]([H:55]):[N:15]:[C:16]2:[C:17]:1:[N:18]:[C:19]([H:56]):[N:20]:2[C@:21]1([H:57])[O:22][C@@:23]([C:24]([O:25][P:26](=[O:27])([O:28][H:58])[O:29][P:30](=[O:31])([O:32][H:59])[O:33][P:34](=[O:35])([O:36][H:60])[O:37][H:61])([H:62])[H:63])([H:64])[C@:38]([O:39][H:65])([H:66])[C@:40]1([O:41][H:67])[H:68])([H:69])[H:70].[H][N:1]([C:2]([C:3]([C:4]([C:5]([C@:6]([N:7]([H:71])[H:72])([C:8](=[O:9])[O:10][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])[H:83].[O:42]=[C:43]([O:44][H:85])[C:45]([C:46]1:[C:47]([H:86]):[N:48]([H:87]):[C:49]2:[C:50]([H:88]):[C:51]([H:89]):[C:52]([H:90]):[C:53]([H:91]):[C:54]:1:2)([H:92])[H:93]>>[N:11]([C:12]1:[N:13]:[C:14]([H:55]):[N:15]:[C:16]2:[C:17]:1:[N:18]:[C:19]([H:56]):[N:20]:2[C@:21]1([H:57])[O:22][C@@:23]([C:24]([O:25][P:26](=[O:27])([O:28][H:58])[O:29][P:30](=[O:31])([O:32][H:59])[O:44][H:85])([H:62])[H:63])([H:64])[C@:38]([O:39][H:65])([H:66])[C@:40]1([O:41][H:67])[H:68])([H:69])[H:70].[N:1]([C:2]([C:3]([C:4]([C:5]([C@:6]([N:7]([H:71])[H:72])([C:8](=[O:9])[O:10][H:73])[H:74])([H:75])[H:76])([H:77])[H:78])([H:79])[H:80])([H:81])[H:82])([C:43](=[O:42])[C:45]([C:46]1:[C:47]([H:86]):[N:48]([H:87]):[C:49]2:[C:50]([H:88]):[C:51]([H:89]):[C:52]([H:90]):[C:53]([H:91]):[C:54]:1:2)([H:92])[H:93])[H:83].[H][O:33][P:34](=[O:35])([O:36][H:60])[O:37][H:61]