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EVODEX.1-R5902

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([N:2]([C:3]([H:48])([H:49])[H:50])[S:4](=[O:5])(=[O:6])[C:7]1:[C:8]([H:51]):[C:9]([H:52]):[C:10]([H:53]):[C:11]2:[C:12]([H:54]):[C:13]([N:14]([C:15](=[O:16])[C@:17]([C:18]([C:19]([C:20]([N:21]([C:22](=[N:23][H:55])[N:24]([H:56])[H:57])[H:58])([H:59])[H:60])([H:61])[H:62])([H:63])[H:64])([N:25]([C:26](=[O:27])[C@:28]3([H:65])[C:29]([H:66])([H:67])[C:30]([H:68])([H:69])[C:31]([H:70])([H:71])[N:32]3[C:33](=[O:34])[C@:35]([N:36]([H:72])[H:73])([C:37]([C:38]3:[C:39]([H:74]):[C:40]([H:75]):[C:41]([H:76]):[C:42]([H:77]):[C:43]:3[H:78])([H:79])[H:80])[H:81])[H:82])[H:83])[H:84]):[C:44]([H:85]):[C:45]([H:86]):[C:46]:1:2)([H:87])([H:88])[H:89].[H][O:47][H:90]>>[C:15](=[O:16])([C@:17]([C:18]([C:19]([C:20]([N:21]([C:22](=[N:23][H:55])[N:24]([H:56])[H:57])[H:58])([H:59])[H:60])([H:61])[H:62])([H:63])[H:64])([N:25]([C:26](=[O:27])[C@:28]1([H:65])[C:29]([H:66])([H:67])[C:30]([H:68])([H:69])[C:31]([H:70])([H:71])[N:32]1[C:33](=[O:34])[C@:35]([N:36]([H:72])[H:73])([C:37]([C:38]1:[C:39]([H:74]):[C:40]([H:75]):[C:41]([H:76]):[C:42]([H:77]):[C:43]:1[H:78])([H:79])[H:80])[H:81])[H:82])[H:83])[O:47][H:90].[H][N:14]([C:13]1:[C:12]([H:54]):[C:11]2:[C:10]([H:53]):[C:9]([H:52]):[C:8]([H:51]):[C:7]([S:4]([N:2]([C:1]([H:87])([H:88])[H:89])[C:3]([H:48])([H:49])[H:50])(=[O:5])=[O:6]):[C:46]:2:[C:45]([H:86]):[C:44]:1[H:85])[H:84]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
245435 D-FPRANSN-C2H5-C2H5 + H2O = D-FPR + ANSN-C2H5-C2H5 False Homo sapiens nan 3.4.21.68

Derived Partial Reactions

EVODEX.1-P5132

[H]N=C(N([H])[H])N([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)[N:14]([C:13]1:[C:12]([H:54]):[C:11]2:[C:10]([H:53]):[C:9]([H:52]):[C:8]([H:51]):[C:7]([S:4]([N:2]([C:1]([H:87])([H:88])[H:89])[C:3]([H:48])([H:49])[H:50])(=[O:5])=[O:6]):[C:46]:2:[C:45]([H:86]):[C:44]:1[H:85])[H:84])N([H])C(=O)[C@@]1([H])N(C(=O)[C@]([H])(N([H])[H])C([H])([H])C2:C([H]):C([H]):C([H]):C([H]):C:2[H])C([H])([H])C([H])([H])C1([H])[H]>>[H][N:14]([C:13]1:[C:12]([H:54]):[C:11]2:[C:10]([H:53]):[C:9]([H:52]):[C:8]([H:51]):[C:7]([S:4]([N:2]([C:1]([H:87])([H:88])[H:89])[C:3]([H:48])([H:49])[H:50])(=[O:5])=[O:6]):[C:46]:2:[C:45]([H:86]):[C:44]:1[H:85])[H:84]

[H]N=C(N([H])[H])N([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)[N:14]([C:13]1:[C:12]([H:54]):[C:11]2:[C:10]([H:53]):[C:9]([H:52]):[C:8]([H:51]):[C:7]([S:4]([N:2]([C:1]([H:87])([H:88])[H:89])[C:3]([H:48])([H:49])[H:50])(=[O:5])=[O:6]):[C:46]:2:[C:45]([H:86]):[C:44]:1[H:85])[H:84])N([H])C(=O)[C@@]1([H])N(C(=O)[C@]([H])(N([H])[H])C([H])([H])C2:C([H]):C([H]):C([H]):C([H]):C:2[H])C([H])([H])C([H])([H])C1([H])[H]>>[H][N:14]([C:13]1:[C:12]([H:54]):[C:11]2:[C:10]([H:53]):[C:9]([H:52]):[C:8]([H:51]):[C:7]([S:4]([N:2]([C:1]([H:87])([H:88])[H:89])[C:3]([H:48])([H:49])[H:50])(=[O:5])=[O:6]):[C:46]:2:[C:45]([H:86]):[C:44]:1[H:85])[H:84]