Ethanol → HCID 22311053, compound
Reaction equation
[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][c:19]2[cH:20][c:21]([C:25]([CH3:26])([CH3:27])[CH3:28])[cH:22][cH:23][cH:24]2)[c:29]2[cH:30][cH:31][c:32]([CH:35]3[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]3)[cH:33][cH:34]2)[cH:12][cH:13]1)=[O:41])[OH:42])=[O:43].[CH3:46][CH2:47][OH:48].[Na+:45].[OH-:44]>>[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][c:19]2[cH:20][c:21]([C:25]([CH3:26])([CH3:27])[CH3:28])[cH:22][cH:23][cH:24]2)[c:29]2[cH:30][cH:31][c:32]([CH:35]3[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]3)[cH:33][cH:34]2)[cH:12][cH:13]1)=[O:41])[OH:42])[OH:43]Participants
5
Sources & evidence
- ORD record
- ord-60ef66d119ed4f658fd202a709174c89
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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