Bicarbonate Ion → a possible structure for AZD-6088
Reaction equation
[CH3:1][C:2]1([N:8]2[CH2:9][CH2:10][CH:11]([N:14]3[C:15](=[O:23])[NH:16][CH:17]4[CH:18]3[CH2:19][CH2:20][CH2:21][CH2:22]4)[CH2:12][CH2:13]2)[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH:24]([N:25]([CH:26]([CH3:27])[CH3:28])[CH2:29][CH3:30])([CH3:31])[CH3:32].[Cl:33][C:34](=[O:35])[O:36][CH:37]([CH3:38])[CH3:39].[Cl:52][CH2:53][Cl:54].[Na+:51].[O-:47][C:48]([OH:49])=[O:50]>>[CH3:1][C:2]1([N:8]2[CH2:9][CH2:10][CH:11]([N:14]3[C:15](=[O:23])[NH:16][CH:17]4[CH:18]3[CH2:19][CH2:20][CH2:21][CH2:22]4)[CH2:12][CH2:13]2)[CH2:3][CH2:4][N:5]([C:34](=[O:35])[O:36][CH:37]([CH3:38])[CH3:39])[CH2:6][CH2:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-fc3ea30bd9144e65b3596d5a8de5a94e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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