Bicarbonate Ion → HCID 68552027, compound
Reaction equation
[CH3:25][O:26][CH:27]([C:28](=[O:29])[OH:30])[CH3:31].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[F:41][c:42]1[c:43]([C:49]2=[N:50][NH:51][C:52]([c:54]3[cH:55][cH:56][cH:57][cH:58][cH:59]3)([CH2:60][O:61][CH2:62][C:63]#[N:64])[S:53]2)[cH:44][c:45]([F:48])[cH:46][cH:47]1.[Na+:74].[O-:70][C:71]([OH:72])=[O:73].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH3:25][O:26][CH:27]([C:28](=[O:30])[N:51]1[N:50]=[C:49]([c:43]2[c:42]([F:41])[cH:47][cH:46][c:45]([F:48])[cH:44]2)[S:53][C:52]1([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[CH2:60][O:61][CH2:62][C:63]#[N:64])[CH3:31]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-91808b01b5ba4f9a8e3fe3b2a9b76470
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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