Bicarbonate Ion → HCID 86635320, compound
Reaction equation
[CH3:42][OH:43].[CH:49]([Cl:50])([Cl:51])[Cl:52].[Na+:48].[O-:44][C:45]([OH:46])=[O:47].[O:17]1[CH2:18][CH2:19][O:20][c:21]2[cH:22][n:23][c:24]([CH2:27][N:28]([C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH:36]3[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]3)[cH:25][c:26]21.[O:1]=[c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([C:15]#[N:16])[n:9][c:10]2[n:11]1[CH2:12][CH:13]=[O:14]>>[O:1]=[c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([C:15]#[N:16])[n:9][c:10]2[n:11]1[CH2:12][CH2:13][N:39]1[CH2:38][CH2:37][CH:36]([N:28]([CH2:27][c:24]2[n:23][cH:22][c:21]3[c:26]([cH:25]2)[O:17][CH2:18][CH2:19][O:20]3)[C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:41][CH2:40]1Participants
7
Sources & evidence
- ORD record
- ord-cc82fdcf0da74f4395e09569b14dda64
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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