Hydrochloric Acid → HCID 53722240, compound
Reaction equation
[Br:41][CH2:42][C:43]([O:44][CH2:46][CH3:47])=[O:45].[C:1]([O-:2])([O-:3])=[O:4].[C:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[NH:27][c:28]1[s:29][cH:30][c:31]([C:33]([C:34](=[O:35])[O:36][CH2:37][CH3:38])=[N:39][OH:40])[n:32]1.[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[ClH:7].[K+:5].[K+:6].[OH2:59]>>[C:1]([OH:2])(=[O:4])[CH:48]([O:40][N:39]=[C:33]([c:31]1[cH:30][s:29][c:28]([NH:27][C:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[n:32]1)[C:34](=[O:35])[O:36][CH2:37][CH3:38])[CH2:46][CH3:47]Participants
9
Sources & evidence
- ORD record
- ord-cc7e5911129c4cbfb09b390dff80df45
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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