SMIRKS
[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][H:63])([H:64])[H:65])([H:66])[H:67])([H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[H:75])([H:76])[H:77])[H:78])[H:79])([H:80])[H:81])[H:82])[O:21][O:22][H:83])([H:84])[H:85])[H:86])[H:87])([H:88])[H:89])([H:90])([H:91])[H:92].[H][N:28]([C@@:27]([C@:25]([C:24]([C:23]([H:103])([H:104])[H:105])([H:101])[H:102])([C:26]([H:93])([H:94])[H:95])[H:100])([C:29](=[O:30])[O:31][H:98])[H:99])[H:96].[N:32]([C:33]1:[N:34]:[C:35]([H:106]):[N:36]:[C:37]2:[C:38]:1:[N:39]:[C:40]([H:107]):[N:41]:2[C@:42]1([H:108])[O:43][C@@:44]([C:45]([O:46][P:47](=[O:48])([O:49][H:109])[O:50][P:51](=[O:52])([O:53][H:110])[O:54][P:55](=[O:56])([O:57][H:111])[O:58][H:112])([H:113])[H:114])([H:115])[C@:59]([O:60][H:116])([H:117])[C@:61]1([O:62][H:118])[H:119])([H:120])[H:121]>>[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[N:28]([C@@:27]([C@:25]([C:24]([C:23]([H:103])([H:104])[H:105])([H:101])[H:102])([C:26]([H:93])([H:94])[H:95])[H:100])([C:29](=[O:30])[O:31][H:98])[H:99])[H:96])([H:64])[H:65])([H:66])[H:67])([H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[H:75])([H:76])[H:77])[H:78])[H:79])([H:80])[H:81])[H:82])[O:21][O:22][H:83])([H:84])[H:85])[H:86])[H:87])([H:88])[H:89])([H:90])([H:91])[H:92].[O:20]([P:47]([O:46][C:45]([C@@:44]1([H:115])[O:43][C@:42]([N:41]2:[C:37]3:[N:36]:[C:35]([H:106]):[N:34]:[C:33]([N:32]([H:120])[H:121]):[C:38]:3:[N:39]:[C:40]:2[H:107])([H:108])[C@@:61]([O:62][H:118])([H:119])[C@@:59]1([O:60][H:116])[H:117])([H:113])[H:114])(=[O:48])[O:49][H:109])[H:63].[H][O:50][P:51](=[O:52])([O:53][H:110])[O:54][P:55](=[O:56])([O:57][H:111])[O:58][H:112]
Derived Operators
EVODEX.1-E138 - Reaction Operator E
[#6:47](-[#6@@:45])(=[#8:48])-[#8:49]-[H:119].[#7:57](-[#6@:56](-[#6@:51])(-[#6:58])-[H:134])(-[H:131])-[H].([#8:79]-[#15:80](=[#8:81])(-[#8:82])-[#8:83]-[#15:84].[#8:89]-[#6@@:88](-[#6@@:73])(-[H:150])-[#6@:90](-[#6@:71])(-[#8:91])-[H:152])>>[#6:47](-[#6@@:45])(=[#8:48])-[#7:57](-[#6@:56](-[#6@:51])(-[#6:58])-[H:134])-[H:131].([#8:49](-[#15:80](-[#8:79])(=[#8:81])-[#8:82])-[H:119].[#8:91]-[#6@:90](-[#6@:71])(-[H:152])-[#6@@:88](-[#6@@:73])(-[#8:89])-[H:150]).[#8:83](-[#15:84])-[H]
EVODEX.1-C164 - Reaction Operator C
[#6:47]-[#8:49].[H]-[#7:57].([#15:80]-[#8:83].[#6@:88]-[#6@:90])>>[#6:47]-[#7:57].([#8:49]-[#15:80].[#6@@:90]-[#6@@:88]).[H]-[#8:83]
EVODEX.1-N79 - Reaction Operator N
[#6:47](-[#6@@:45])(=[#8:48])-[#8:49]-[H:119].[H]-[#7:57](-[#6@:56])-[H:131].([#8:79]-[#15:80](=[#8:81])(-[#8:82])-[#8:83]-[#15:84].[#8:89]-[#6@@:88](-[#6@@:73])(-[H:150])-[#6@:90](-[#6@:71])(-[#8:91])-[H:152])>>[#6:47](-[#6@@:45])(=[#8:48])-[#7:57](-[#6@:56])-[H:131].([#8:49](-[#15:80](-[#8:79])(=[#8:81])-[#8:82])-[H:119].[#8:91]-[#6@:90](-[#6@:71])(-[H:152])-[#6@@:88](-[#6@@:73])(-[#8:89])-[H:150]).[H]-[#8:83]-[#15:84]
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-R7881
[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][H:63])([H:64])[H:65])([H:66])[H:67])([H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[H:75])([H:76])[H:77])[H:78])[H:79])([H:80])[H:81])[H:82])[O:21][O:22][H:83])([H:84])[H:85])[H:86])[H:87])([H:88])[H:89])([H:90])([H:91])[H:92].[H][N:28]([C@@:27]([C@:25]([C:24]([C:23]([H:103])([H:104])[H:105])([H:101])[H:102])([C:26]([H:93])([H:94])[H:95])[H:100])([C:29](=[O:30])[O:31][H:98])[H:99])[H:96].[N:32]([C:33]1:[N:34]:[C:35]([H:106]):[N:36]:[C:37]2:[C:38]:1:[N:39]:[C:40]([H:107]):[N:41]:2[C@:42]1([H:108])[O:43][C@@:44]([C:45]([O:46][P:47](=[O:48])([O:49][H:109])[O:50][P:51](=[O:52])([O:53][H:110])[O:54][P:55](=[O:56])([O:57][H:111])[O:58][H:112])([H:113])[H:114])([H:115])[C@:59]([O:60][H:116])([H:117])[C@:61]1([O:62][H:118])[H:119])([H:120])[H:121]>>[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[N:28]([C@@:27]([C@:25]([C:24]([C:23]([H:103])([H:104])[H:105])([H:101])[H:102])([C:26]([H:93])([H:94])[H:95])[H:100])([C:29](=[O:30])[O:31][H:98])[H:99])[H:96])([H:64])[H:65])([H:66])[H:67])([H:68])[H:69])([H:70])[H:71])([H:72])[H:73])([H:74])[H:75])([H:76])[H:77])[H:78])[H:79])([H:80])[H:81])[H:82])[O:21][O:22][H:83])([H:84])[H:85])[H:86])[H:87])([H:88])[H:89])([H:90])([H:91])[H:92].[O:20]([P:47]([O:46][C:45]([C@@:44]1([H:115])[O:43][C@:42]([N:41]2:[C:37]3:[N:36]:[C:35]([H:106]):[N:34]:[C:33]([N:32]([H:120])[H:121]):[C:38]:3:[N:39]:[C:40]:2[H:107])([H:108])[C@@:61]([O:62][H:118])([H:119])[C@@:59]1([O:60][H:116])[H:117])([H:113])[H:114])(=[O:48])[O:49][H:109])[H:63].[H][O:50][P:51](=[O:52])([O:53][H:110])[O:54][P:55](=[O:56])([O:57][H:111])[O:58][H:112]