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EVODEX.1-R271

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:52])([H:53])[H:54])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])[H:43])[H:42])([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:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])([H:32])[H:33])([H:34])[H:35])([H:36])[H:37])[H:38])[H:39])[H:40].[O:21]=[O:22]>>[H][O:22][O:21][C:10]([C:9](=[C:8]([C:7](=[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:52])([H:53])[H:54])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])[H:43])[H:42])[H:40])[H:39])([C:11]([C:12]([C:13]([C:14]([C:15]([C:16]([C:17]([C:18](=[O:19])[O:20][H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])[H:31])([H:32])[H:33])([H:34])[H:35])([H:36])[H:37])[H:38]

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]

[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]