SMIRKS
[H][C@@:22]1([O:23][H])[C:21]([H:56])([H:57])[C@@:20]2([H:55])[C:18](=[O:19])[C:17]([H:54])=[C:16]3[C@:14]4([O:15][H:53])[C:13]([H:51])([H:52])[C:12]([H:49])([H:50])[C@@:11]([C@:2]([C:1]([H:76])([H:77])[H:78])([C@:3]([O:4][H:35])([C:5]([C:6]([C:7]([C:8]([H:36])([H:37])[H:38])([C:9]([H:39])([H:40])[H:41])[O:10][H:42])([H:43])[H:44])([H:45])[H:46])[H:47])[H:75])([H:48])[C@@:31]4([C:32]([H:72])([H:73])[H:74])[C:30]([H:70])([H:71])[C:29]([H:68])([H:69])[C@:28]3([H:67])[C@@:26]2([C:27]([H:64])([H:65])[H:66])[C:25]([H:62])([H:63])[C:24]1([H:60])[H:61].[O:33]=[O:34]>>[C:1]([C@:2]([C@:3]([O:4][H:35])([C:5]([C:6]([C:7]([C:8]([H:36])([H:37])[H:38])([C:9]([H:39])([H:40])[H:41])[O:10][H:42])([H:43])[H:44])([H:45])[H:46])[H:47])([C@@:11]1([H:48])[C:12]([H:49])([H:50])[C:13]([H:51])([H:52])[C@@:14]2([O:15][H:53])[C:16]3=[C:17]([H:54])[C:18](=[O:19])[C@:20]4([H:55])[C:21]([H:56])([H:57])[C:22](=[O:23])[C:24]([H:60])([H:61])[C:25]([H:62])([H:63])[C@:26]4([C:27]([H:64])([H:65])[H:66])[C@@:28]3([H:67])[C:29]([H:68])([H:69])[C:30]([H:70])([H:71])[C@:31]12[C:32]([H:72])([H:73])[H:74])[H:75])([H:76])([H:77])[H:78].[H][O:33][O:34][H]
Source Database Data
Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
---|---|---|---|---|---|---|
31116 | 2-deoxyecdysone + O2 = 3-dehydro-2-deoxyecdysone + H2O2 | False | Calliphora vicina | nan | 1.1.3.16 |
Derived Partial Reactions
EVODEX.1-P114
[H][C@@:22]1([O:23][H])[C:21]([H:56])([H:57])[C@@:20]2([H:55])[C:18](=[O:19])[C:17]([H:54])=[C:16]3[C@:14]4([O:15][H:53])[C:13]([H:51])([H:52])[C:12]([H:49])([H:50])[C@@:11]([C@:2]([C:1]([H:76])([H:77])[H:78])([C@:3]([O:4][H:35])([C:5]([C:6]([C:7]([C:8]([H:36])([H:37])[H:38])([C:9]([H:39])([H:40])[H:41])[O:10][H:42])([H:43])[H:44])([H:45])[H:46])[H:47])[H:75])([H:48])[C@@:31]4([C:32]([H:72])([H:73])[H:74])[C:30]([H:70])([H:71])[C:29]([H:68])([H:69])[C@:28]3([H:67])[C@@:26]2([C:27]([H:64])([H:65])[H:66])[C:25]([H:62])([H:63])[C:24]1([H:60])[H:61].[O:33]=[O:34]>>[C:1]([C@:2]([C@:3]([O:4][H:35])([C:5]([C:6]([C:7]([C:8]([H:36])([H:37])[H:38])([C:9]([H:39])([H:40])[H:41])[O:10][H:42])([H:43])[H:44])([H:45])[H:46])[H:47])([C@@:11]1([H:48])[C:12]([H:49])([H:50])[C:13]([H:51])([H:52])[C@@:14]2([O:15][H:53])[C:16]3=[C:17]([H:54])[C:18](=[O:19])[C@:20]4([H:55])[C:21]([H:56])([H:57])[C:22](=[O:23])[C:24]([H:60])([H:61])[C:25]([H:62])([H:63])[C@:26]4([C:27]([H:64])([H:65])[H:66])[C@@:28]3([H:67])[C:29]([H:68])([H:69])[C:30]([H:70])([H:71])[C@:31]12[C:32]([H:72])([H:73])[H:74])[H:75])([H:76])([H:77])[H:78].[H][O:33][O:34][H]