SMIRKS
[H][C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:74])([H:75])[H:76])([H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])[H:65])[H:64])([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:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])([H:52])[H:53])([H:54])[H:55])([H:56])[H:57])([H:58])[H:59])[H:60])[H:61])[H:62].[H][C:28]([C:27](=[C:26]([C:25]([C:24]([C:23]([C:22]([C:21]([H:106])([H:107])[H:108])([H:104])[H:105])([H:102])[H:103])([H:100])[H:101])([H:98])[H:99])[H:97])[H:96])([C:29](=[C:30]([C:31]([C:32]([C:33]([C:34]([C:35]([C:36]([C:37]([C:38](=[O:39])[O:40][H:77])([H:78])[H:79])([H:80])[H:81])([H:82])[H:83])([H:84])[H:85])([H:86])[H:87])([H:88])[H:89])([H:90])[H:91])[H:92])[H:93])[H:94].[O:41]=[O:42].[O:43]=[O:44]>>[H][O:44][O:43][C:10]([C:9](=[C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:74])([H:75])[H:76])([H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])[H:65])[H:64])[H:62])[H:61])([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])([H:52])[H:53])([H:54])[H:55])([H:56])[H:57])([H:58])[H:59])[H:60].[H][O:41][O:42][C:26]([C:25]([C:24]([C:23]([C:22]([C:21]([H:106])([H:107])[H:108])([H:104])[H:105])([H:102])[H:103])([H:100])[H:101])([H:98])[H:99])([C:27](=[C:28]([C:29](=[C:30]([C:31]([C:32]([C:33]([C:34]([C:35]([C:36]([C:37]([C:38](=[O:39])[O:40][H:77])([H:78])[H:79])([H:80])[H:81])([H:82])[H:83])([H:84])[H:85])([H:86])[H:87])([H:88])[H:89])([H:90])[H:91])[H:92])[H:93])[H:94])[H:96])[H:97]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
39397 | linoleate + O2 = 9-hydroperoxy octadecadienoic acid + 13-hydroperoxy octadecadienoic acid | True | Lasiodiplodia theobromae | nan | 1.13.11.12 |
Derived Partial Reactions
EVODEX.1-P229
[H][C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:74])([H:75])[H:76])([H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])[H:65])[H:64])([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:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])([H:52])[H:53])([H:54])[H:55])([H:56])[H:57])([H:58])[H:59])[H:60])[H:61])[H:62]>>[H]OO[C:10]([C:9](=[C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:74])([H:75])[H:76])([H:72])[H:73])([H:70])[H:71])([H:68])[H:69])([H:66])[H:67])[H:65])[H:64])[H:62])[H:61])([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])([H:52])[H:53])([H:54])[H:55])([H:56])[H:57])([H:58])[H:59])[H:60]