Hydrochloric Acid → HCID 20584779, compound
Reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:1][O:2][C:3]([CH:4]([CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][N:15]([C:16](=[O:17])[NH:18][CH:19]([CH3:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[c:28]2[cH:29][cH:30][c:31]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[cH:32][cH:33]2)[cH:12][cH:13]1)=[O:40])[OH:41])=[O:42].[CH3:49][OH:50].[ClH:43].[Na+:52].[OH-:51]>>[O:2]=[C:3]([CH:4]([CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][N:15]([C:16](=[O:17])[NH:18][CH:19]([CH3:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[c:28]2[cH:29][cH:30][c:31]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[cH:32][cH:33]2)[cH:12][cH:13]1)=[O:40])[OH:41])[OH:42]Participants
7
Sources & evidence
- ORD record
- ord-09713c92edec464c866eeebe601e503d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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