SMIRKS
[C:20]([C:21]([C:22]([C:23]([C:24]([C:25]([C:26]([C:27]([C:28](=[C:29]([C:30]([C:31]([C:32]([C:33]([C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41](=[O:42])[S:43][C:44]([C:45]([N:46]([C:47](=[O:48])[C:49]([C:50]([N:51]([C:52](=[O:53])[C@:54]([O:55][H:125])([C:56]([C:57]([H:126])([H:127])[H:128])([C:58]([H:129])([H:130])[H:131])[C:59]([O:60][P:61](=[O:62])([O:63][H:132])[O:64][P:65](=[O:66])([O:67][H:133])[O:68][C:69]([C@@:70]1([H:134])[O:71][C@:72]([N:73]2:[C:74]([H:135]):[N:75]:[C:76]3:[C:77]([N:78]([H:136])[H:137]):[N:79]:[C:80]([H:138]):[N:81]:[C:82]:2:3)([H:139])[C@@:83]([O:84][H:140])([H:141])[C@@:85]1([O:86][P:87](=[O:88])([O:89][H:142])[O:90][H:143])[H:144])([H:145])[H:146])([H:147])[H:148])[H:149])[H:150])([H:151])[H:152])([H:153])[H:154])[H:155])([H:156])[H:157])([H:158])[H:159])([H:160])[H:161])([H:162])[H:163])([H:164])[H:165])([H:166])[H:167])([H:168])[H:169])([H:170])[H:171])([H:172])[H:173])([H:174])[H:175])([H:176])[H:177])([H:178])[H:179])([H:180])[H:181])[H:182])[H:183])([H:184])[H:185])([H:186])[H:187])([H:188])[H:189])([H:190])[H:191])([H:192])[H:193])([H:194])[H:195])([H:196])[H:197])([H:198])([H:199])[H:200]>>[H]C(=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])O[C:41]([C:40]([C:39]([C:38]([C:37]([C:36]([C:35]([C:34]([C:33]([C:32]([C:31]([C:30]([C:29](=[C:28]([C:27]([C:26]([C:25]([C:24]([C:23]([C:22]([C:21]([C:20]([H:198])([H:199])[H:200])([H:196])[H:197])([H:194])[H:195])([H:192])[H:193])([H:190])[H:191])([H:188])[H:189])([H:186])[H:187])([H:184])[H:185])[H:183])[H:182])([H:180])[H:181])([H:178])[H:179])([H:176])[H:177])([H:174])[H:175])([H:172])[H:173])([H:170])[H:171])([H:168])[H:169])([H:166])[H:167])([H:164])[H:165])([H:162])[H:163])([H:160])[H:161])=[O:42].[H][S:43][C:44]([C:45]([N:46]([C:47](=[O:48])[C:49]([C:50]([N:51]([C:52](=[O:53])[C@:54]([O:55][H:125])([C:56]([C:57]([H:126])([H:127])[H:128])([C:58]([H:129])([H:130])[H:131])[C:59]([O:60][P:61](=[O:62])([O:63][H:132])[O:64][P:65](=[O:66])([O:67][H:133])[O:68][C:69]([C@@:70]1([H:134])[O:71][C@:72]([N:73]2:[C:74]([H:135]):[N:75]:[C:76]3:[C:77]([N:78]([H:136])[H:137]):[N:79]:[C:80]([H:138]):[N:81]:[C:82]:2:3)([H:139])[C@@:83]([O:84][H:140])([H:141])[C@@:85]1([O:86][P:87](=[O:88])([O:89][H:142])[O:90][H:143])[H:144])([H:145])[H:146])([H:147])[H:148])[H:149])[H:150])([H:151])[H:152])([H:153])[H:154])[H:155])([H:156])[H:157])([H:158])[H:159]
Derived Operators
EVODEX.1-F130 - Elemental Balance
| O | 1 |
| C | 18 |
| H | 34 |
EVODEX.1-M187 - Mass Difference
266.26112
EVODEX.1-E770 - Reaction Operator E
[#6:36]-[#6:37](=[#8:38])-[#16:39]-[#6:40]>>[#6](-[#6](-[#6](-[#6](-[#6](-[#6](=[#6](-[#6](-[#6](=[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#6](-[#8]-[#6:37](-[#6:36])=[#8:38])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])-[H])(-[H])(-[H])-[H].[#16:39](-[#6:40])-[H]
EVODEX.1-C361 - Reaction Operator C
[#6:35]-[#16:37]>>[H]-[#6](=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#8]-[#6:35].[H]-[#16:37]
EVODEX.1-N414 - Reaction Operator N
[#6:34]-[#6:35](=[#8:36])-[#16:37]-[#6:38]>>[H]-[#6](=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[H])-[#6](-[H])(-[H])-[#6](-[H])=[#6](-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#8]-[#6:35](-[#6:34])=[#8:36].[H]-[#16:37]-[#6:38]
EVODEX.1-Em6 - Reaction Operator Em
[#6:36]-[#6:37](=[#8:38])-[#16:39]-[#6:40]>>[#6]-[#8]-[#6:37](-[#6:36])=[#8:38].[H]-[#16:39]-[#6:40]
EVODEX.1-Nm7 - Reaction Operator Nm
[#6:36]-[#6:37](=[#8:38])-[#16:39]-[#6:40]>>[#6]-[#8]-[#6:37](-[#6:36])=[#8:38].[H]-[#16:39]-[#6:40]
Source Full Reactions
EVODEX.1-R2611
[H][O:19][C:18]([C:17]([C:16]([C:15]([C:14]([C:13]([C:12]([C:11]([C:10](=[C:9]([C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:122])([H:123])[H:124])([H:120])[H:121])([H:118])[H:119])([H:116])[H:117])([H:114])[H:115])[H:113])[H:112])([H:110])[H:111])[H:109])[H:108])([H:106])[H:107])([H:104])[H:105])([H:102])[H:103])([H:100])[H:101])([H:98])[H:99])([H:96])[H:97])([H:94])[H:95])([H:92])[H:93].[C:20]([C:21]([C:22]([C:23]([C:24]([C:25]([C:26]([C:27]([C:28](=[C:29]([C:30]([C:31]([C:32]([C:33]([C:34]([C:35]([C:36]([C:37]([C:38]([C:39]([C:40]([C:41](=[O:42])[S:43][C:44]([C:45]([N:46]([C:47](=[O:48])[C:49]([C:50]([N:51]([C:52](=[O:53])[C@:54]([O:55][H:125])([C:56]([C:57]([H:126])([H:127])[H:128])([C:58]([H:129])([H:130])[H:131])[C:59]([O:60][P:61](=[O:62])([O:63][H:132])[O:64][P:65](=[O:66])([O:67][H:133])[O:68][C:69]([C@@:70]1([H:134])[O:71][C@:72]([N:73]2:[C:74]([H:135]):[N:75]:[C:76]3:[C:77]([N:78]([H:136])[H:137]):[N:79]:[C:80]([H:138]):[N:81]:[C:82]:2:3)([H:139])[C@@:83]([O:84][H:140])([H:141])[C@@:85]1([O:86][P:87](=[O:88])([O:89][H:142])[O:90][H:143])[H:144])([H:145])[H:146])([H:147])[H:148])[H:149])[H:150])([H:151])[H:152])([H:153])[H:154])[H:155])([H:156])[H:157])([H:158])[H:159])([H:160])[H:161])([H:162])[H:163])([H:164])[H:165])([H:166])[H:167])([H:168])[H:169])([H:170])[H:171])([H:172])[H:173])([H:174])[H:175])([H:176])[H:177])([H:178])[H:179])([H:180])[H:181])[H:182])[H:183])([H:184])[H:185])([H:186])[H:187])([H:188])[H:189])([H:190])[H:191])([H:192])[H:193])([H:194])[H:195])([H:196])[H:197])([H:198])([H:199])[H:200]>>[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][C:41]([C:40]([C:39]([C:38]([C:37]([C:36]([C:35]([C:34]([C:33]([C:32]([C:31]([C:30]([C:29](=[C:28]([C:27]([C:26]([C:25]([C:24]([C:23]([C:22]([C:21]([C:20]([H:198])([H:199])[H:200])([H:196])[H:197])([H:194])[H:195])([H:192])[H:193])([H:190])[H:191])([H:188])[H:189])([H:186])[H:187])([H:184])[H:185])[H:183])[H:182])([H:180])[H:181])([H:178])[H:179])([H:176])[H:177])([H:174])[H:175])([H:172])[H:173])([H:170])[H:171])([H:168])[H:169])([H:166])[H:167])([H:164])[H:165])([H:162])[H:163])([H:160])[H:161])=[O:42])([H:92])[H:93])([H:94])[H:95])([H:96])[H:97])([H:98])[H:99])([H:100])[H:101])([H:102])[H:103])([H:104])[H:105])([H:106])[H:107])[H:108])[H:109])([H:110])[H:111])[H:112])[H:113])([H:114])[H:115])([H:116])[H:117])([H:118])[H:119])([H:120])[H:121])([H:122])([H:123])[H:124].[H][S:43][C:44]([C:45]([N:46]([C:47](=[O:48])[C:49]([C:50]([N:51]([C:52](=[O:53])[C@:54]([O:55][H:125])([C:56]([C:57]([H:126])([H:127])[H:128])([C:58]([H:129])([H:130])[H:131])[C:59]([O:60][P:61](=[O:62])([O:63][H:132])[O:64][P:65](=[O:66])([O:67][H:133])[O:68][C:69]([C@@:70]1([H:134])[O:71][C@:72]([N:73]2:[C:74]([H:135]):[N:75]:[C:76]3:[C:77]([N:78]([H:136])[H:137]):[N:79]:[C:80]([H:138]):[N:81]:[C:82]:2:3)([H:139])[C@@:83]([O:84][H:140])([H:141])[C@@:85]1([O:86][P:87](=[O:88])([O:89][H:142])[O:90][H:143])[H:144])([H:145])[H:146])([H:147])[H:148])[H:149])[H:150])([H:151])[H:152])([H:153])[H:154])[H:155])([H:156])[H:157])([H:158])[H:159]