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EVODEX.1-R7067

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C:13]([C:12]([C:11]([C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:50])([H:51])[H:52])[C:3]([H:25])([H:26])[H:27])[H:49])([H:47])[H:48])([H:45])[H:46])[C:8]([H:28])([H:29])[H:30])[H:44])([H:42])[H:43])([H:40])[H:41])=[C:14]([C:15]([O:16][P:17](=[O:18])([O:19][H:34])[O:20][P:21](=[O:22])([O:23][H:35])[O:24][H:36])([H:37])[H:38])[H:39])([H:31])[H:32]>>[C:1]([C:2]([C:3]([H:25])([H:26])[H:27])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:28])([H:29])[H:30])=[C:9]([C:10]([C:11]([C:12](=[C:13]([H:31])[H:32])[C:14](=[C:15]([H:37])[H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([H:45])[H:46])([H:47])[H:48])[H:49])([H:50])([H:51])[H:52].[H][O:16][P:17](=[O:18])([O:19][H:34])[O:20][P:21](=[O:22])([O:23][H:35])[O:24][H:36]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
293311 (2E,6E)-farnesyl diphosphate = (3E,6E)-alpha-farnesene + beta-farnesene + diphosphate False Malus domestica Q84LB2 uniprot 4.2.3.46

Derived Partial Reactions

EVODEX.1-P6483

[H]OP(=O)(O[H])OP(=O)(O[H])O[C:15]([C:14](=[C:12]([C:11]([C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:74])([H:75])[H:76])[C:3]([H:49])([H:50])[H:51])[H:73])([H:71])[H:72])([H:69])[H:70])[C:8]([H:52])([H:53])[H:54])[H:68])([H:66])[H:67])([H:64])[H:65])[C:13]([H])([H:55])[H:56])[H:63])([H:61])[H:62]>>[C:1]([C:2]([C:3]([H:49])([H:50])[H:51])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:52])([H:53])[H:54])=[C:9]([C:10]([C:11]([C:12](=[C:13]([H:55])[H:56])[C:14](=[C:15]([H:61])[H:62])[H:63])([H:64])[H:65])([H:66])[H:67])[H:68])([H:69])[H:70])([H:71])[H:72])[H:73])([H:74])([H:75])[H:76]

[H]OP(=O)(O[H])OP(=O)(O[H])O[C:15]([C:14](=[C:12]([C:11]([C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:74])([H:75])[H:76])[C:3]([H:49])([H:50])[H:51])[H:73])([H:71])[H:72])([H:69])[H:70])[C:8]([H:52])([H:53])[H:54])[H:68])([H:66])[H:67])([H:64])[H:65])[C:13]([H])([H:55])[H:56])[H:63])([H:61])[H:62]>>[C:1]([C:2]([C:3]([H:49])([H:50])[H:51])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:52])([H:53])[H:54])=[C:9]([C:10]([C:11]([C:12](=[C:13]([H:55])[H:56])[C:14](=[C:15]([H:61])[H:62])[H:63])([H:64])[H:65])([H:66])[H:67])[H:68])([H:69])[H:70])([H:71])[H:72])[H:73])([H:74])([H:75])[H:76]

EVODEX.1-P6484

[H][C:13]([C:12]([C:11]([C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:74])([H:75])[H:76])[C:3]([H:49])([H:50])[H:51])[H:73])([H:71])[H:72])([H:69])[H:70])[C:8]([H:52])([H:53])[H:54])[H:68])([H:66])[H:67])([H:64])[H:65])=[C:14]([C:15]([O:16][P:17](=[O:18])([O:19][H:58])[O:20][P:21](=[O:22])([O:23][H:59])[O:24][H:60])([H:61])[H:62])[H:63])([H:55])[H:56]>>[C:1]([C:2]([C:3]([H:49])([H:50])[H:51])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:52])([H:53])[H:54])=[C:9]([C:10]([C:11]([C:12](=[C:13]([H:55])[H:56])[C:14](=[C:15]([H:61])[H:62])[H:63])([H:64])[H:65])([H:66])[H:67])[H:68])([H:69])[H:70])([H:71])[H:72])[H:73])([H:74])([H:75])[H:76].[H][O:16][P:17](=[O:18])([O:19][H:58])[O:20][P:21](=[O:22])([O:23][H:59])[O:24][H:60]

[H][C:13]([C:12]([C:11]([C:10]([C:9](=[C:7]([C:6]([C:5]([C:4](=[C:2]([C:1]([H:74])([H:75])[H:76])[C:3]([H:49])([H:50])[H:51])[H:73])([H:71])[H:72])([H:69])[H:70])[C:8]([H:52])([H:53])[H:54])[H:68])([H:66])[H:67])([H:64])[H:65])=[C:14]([C:15]([O:16][P:17](=[O:18])([O:19][H:58])[O:20][P:21](=[O:22])([O:23][H:59])[O:24][H:60])([H:61])[H:62])[H:63])([H:55])[H:56]>>[C:1]([C:2]([C:3]([H:49])([H:50])[H:51])=[C:4]([C:5]([C:6]([C:7]([C:8]([H:52])([H:53])[H:54])=[C:9]([C:10]([C:11]([C:12](=[C:13]([H:55])[H:56])[C:14](=[C:15]([H:61])[H:62])[H:63])([H:64])[H:65])([H:66])[H:67])[H:68])([H:69])[H:70])([H:71])[H:72])[H:73])([H:74])([H:75])[H:76].[H][O:16][P:17](=[O:18])([O:19][H:58])[O:20][P:21](=[O:22])([O:23][H:59])[O:24][H:60]