EVODEX.1-R848

SMIRKS

[H][C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:157])([H:158])[H:159])[C:3]([H:96])([H:97])[H:98])[H:156])([H:154])[H:155])([H:152])[H:153])[C:8]([H:99])([H:100])[H:101])[H:151])([C:11]([H])([C:12]([C:13]([H:102])([H:103])[H:104])=[C:14]([C:15]([C:16]([C:17]([C:18]([H:105])([H:106])[H:107])=[C:19]([C:20](=[C:21]([C:22](=[C:23]([C:24]([H:108])([H:109])[H:110])[C:25]([C:26]([C:27](=[C:28]([C:29]([H:111])([H:112])[H:113])[C:30]([C:31]([C:32](=[C:33]([C:34]([H:114])([H:115])[H:116])[C:35]([C:36]([C:37](=[C:38]([C:39]([H:117])([H:118])[H:119])[C:40]([H:120])([H:121])[H:122])[H:123])([H:124])[H:125])([H:126])[H:127])[H:128])([H:129])[H:130])([H:131])[H:132])[H:133])([H:134])[H:135])([H:136])[H:137])[H:138])[H:139])[H:140])[H:141])([H:142])[H:143])([H:144])[H:145])[H:146])[H:147])[H:149].[C:41]([C:42]([C:43]([H:160])([H:161])[H:162])=[C:44]([C:45]([C:46]([C:47]([C:48]([H:163])([H:164])[H:165])=[C:49]([C:50]([C:51]([C:52]([C:53]([H:166])([H:167])[H:168])=[C:54]([C:55]([C:56]([C:57]([C:58]([H:169])([H:170])[H:171])=[C:59]([C:60]([C:61]([C:62]([C:63]([H:172])([H:173])[H:174])=[C:64]([C:65]([C:66]([C:67]([C:68]([H:175])([H:176])[H:177])=[C:69]([C:70]([C:71]([C:72]([C:73]([H:178])([H:179])[H:180])=[C:74]([C:75]([C:76]([C:77]([C:78]([H:181])([H:182])[H:183])=[C:79]([C:80]([C:81]([C:82]([C:83]([H:184])([H:185])[H:186])=[C:84]([C:85]([C:86]1=[C:87]([H:187])[C:88](=[O:89])[C:90]([C:91]([H:188])([H:189])[H:190])=[C:92]([C:93]([H:191])([H:192])[H:193])[C:94]1=[O:95])([H:194])[H:195])[H:196])([H:197])[H:198])([H:199])[H:200])[H:201])([H:202])[H:203])([H:204])[H:205])[H:206])([H:207])[H:208])([H:209])[H:210])[H:211])([H:212])[H:213])([H:214])[H:215])[H:216])([H:217])[H:218])([H:219])[H:220])[H:221])([H:222])[H:223])([H:224])[H:225])[H:226])([H:227])[H:228])([H:229])[H:230])[H:231])([H:232])[H:233])([H:234])[H:235])[H:236])([H:237])([H:238])[H:239]>>[C:1]([C:2]([C:3]([H:96])([H:97])[H:98])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:99])([H:100])[H:101])=[C:9]([C:10](=[C:11]([C:12]([C:13]([H:102])([H:103])[H:104])=[C:14]([C:15]([C:16]([C:17]([C:18]([H:105])([H:106])[H:107])=[C:19]([C:20](=[C:21]([C:22](=[C:23]([C:24]([H:108])([H:109])[H:110])[C:25]([C:26]([C:27](=[C:28]([C:29]([H:111])([H:112])[H:113])[C:30]([C:31]([C:32](=[C:33]([C:34]([H:114])([H:115])[H:116])[C:35]([C:36]([C:37](=[C:38]([C:39]([H:117])([H:118])[H:119])[C:40]([H:120])([H:121])[H:122])[H:123])([H:124])[H:125])([H:126])[H:127])[H:128])([H:129])[H:130])([H:131])[H:132])[H:133])([H:134])[H:135])([H:136])[H:137])[H:138])[H:139])[H:140])[H:141])([H:142])[H:143])([H:144])[H:145])[H:146])[H:147])[H:149])[H:151])([H:152])[H:153])([H:154])[H:155])[H:156])([H:157])([H:158])[H:159].[H][O:89][C:88]1:[C:87]([H:187]):[C:86]([C:85]([C:84](=[C:82]([C:81]([C:80]([C:79](=[C:77]([C:76]([C:75]([C:74](=[C:72]([C:71]([C:70]([C:69](=[C:67]([C:66]([C:65]([C:64](=[C:62]([C:61]([C:60]([C:59](=[C:57]([C:56]([C:55]([C:54](=[C:52]([C:51]([C:50]([C:49](=[C:47]([C:46]([C:45]([C:44](=[C:42]([C:41]([H:237])([H:238])[H:239])[C:43]([H:160])([H:161])[H:162])[H:236])([H:234])[H:235])([H:232])[H:233])[C:48]([H:163])([H:164])[H:165])[H:231])([H:229])[H:230])([H:227])[H:228])[C:53]([H:166])([H:167])[H:168])[H:226])([H:224])[H:225])([H:222])[H:223])[C:58]([H:169])([H:170])[H:171])[H:221])([H:219])[H:220])([H:217])[H:218])[C:63]([H:172])([H:173])[H:174])[H:216])([H:214])[H:215])([H:212])[H:213])[C:68]([H:175])([H:176])[H:177])[H:211])([H:209])[H:210])([H:207])[H:208])[C:73]([H:178])([H:179])[H:180])[H:206])([H:204])[H:205])([H:202])[H:203])[C:78]([H:181])([H:182])[H:183])[H:201])([H:199])[H:200])([H:197])[H:198])[C:83]([H:184])([H:185])[H:186])[H:196])([H:194])[H:195]):[C:94]([O:95][H]):[C:92]([C:93]([H:191])([H:192])[H:193]):[C:90]:1[C:91]([H:188])([H:189])[H:190]

Source Database Data

Derived Partial Reactions

EVODEX.1-P873

[C:41]([C:42]([C:43]([H:215])([H:216])[H:217])=[C:44]([C:45]([C:46]([C:47]([C:48]([H:218])([H:219])[H:220])=[C:49]([C:50]([C:51]([C:52]([C:53]([H:221])([H:222])[H:223])=[C:54]([C:55]([C:56]([C:57]([C:58]([H:224])([H:225])[H:226])=[C:59]([C:60]([C:61]([C:62]([C:63]([H:227])([H:228])[H:229])=[C:64]([C:65]([C:66]([C:67]([C:68]([H:230])([H:231])[H:232])=[C:69]([C:70]([C:71]([C:72]([C:73]([H:233])([H:234])[H:235])=[C:74]([C:75]([C:76]([C:77]([C:78]([H:236])([H:237])[H:238])=[C:79]([C:80]([C:81]([C:82]([C:83]([H:239])([H:240])[H:241])=[C:84]([C:85]([C:86]1=[C:87]([H:242])[C:88](=[O:89])[C:90]([C:91]([H:243])([H:244])[H:245])=[C:92]([C:93]([H:246])([H:247])[H:248])[C:94]1=[O:95])([H:249])[H:250])[H:251])([H:252])[H:253])([H:254])[H:255])[H:256])([H:257])[H:258])([H:259])[H:260])[H:261])([H:262])[H:263])([H:264])[H:265])[H:266])([H:267])[H:268])([H:269])[H:270])[H:271])([H:272])[H:273])([H:274])[H:275])[H:276])([H:277])[H:278])([H:279])[H:280])[H:281])([H:282])[H:283])([H:284])[H:285])[H:286])([H:287])[H:288])([H:289])[H:290])[H:291])([H:292])([H:293])[H:294]>>[H][O:89][C:88]1:[C:87]([H:242]):[C:86]([C:85]([C:84](=[C:82]([C:81]([C:80]([C:79](=[C:77]([C:76]([C:75]([C:74](=[C:72]([C:71]([C:70]([C:69](=[C:67]([C:66]([C:65]([C:64](=[C:62]([C:61]([C:60]([C:59](=[C:57]([C:56]([C:55]([C:54](=[C:52]([C:51]([C:50]([C:49](=[C:47]([C:46]([C:45]([C:44](=[C:42]([C:41]([H:292])([H:293])[H:294])[C:43]([H:215])([H:216])[H:217])[H:291])([H:289])[H:290])([H:287])[H:288])[C:48]([H:218])([H:219])[H:220])[H:286])([H:284])[H:285])([H:282])[H:283])[C:53]([H:221])([H:222])[H:223])[H:281])([H:279])[H:280])([H:277])[H:278])[C:58]([H:224])([H:225])[H:226])[H:276])([H:274])[H:275])([H:272])[H:273])[C:63]([H:227])([H:228])[H:229])[H:271])([H:269])[H:270])([H:267])[H:268])[C:68]([H:230])([H:231])[H:232])[H:266])([H:264])[H:265])([H:262])[H:263])[C:73]([H:233])([H:234])[H:235])[H:261])([H:259])[H:260])([H:257])[H:258])[C:78]([H:236])([H:237])[H:238])[H:256])([H:254])[H:255])([H:252])[H:253])[C:83]([H:239])([H:240])[H:241])[H:251])([H:249])[H:250]):[C:94]([O:95][H]):[C:92]([C:93]([H:246])([H:247])[H:248]):[C:90]:1[C:91]([H:243])([H:244])[H:245]