Ethanol → HCID 11963015, compound
Reaction equation
[CH3:51][CH2:52][OH:53].[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[NH2:54][NH2:55].[Na+:60].[O-:56][C:57]([OH:58])=[O:59].[O:1]=[C:2]1[N:3]([CH2:12][CH2:13][n:14]2[n:15](-[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[c:16](=[O:43])[c:17]([C:20](=[O:21])[NH:22][c:23]3[cH:24][c:25]([F:42])[c:26]([O:29][c:30]4[cH:31][cH:32][n:33][c:34]5[cH:35][c:36]([O:40][CH3:41])[cH:37][cH:38][c:39]45)[cH:27][cH:28]3)[c:18]2[CH3:19])[C:10](=[O:11])[c:5]2[c:4]1[cH:9][cH:8][cH:7][cH:6]2.[OH2:50]>>[NH2:3][CH2:12][CH2:13][n:14]1[n:15](-[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:16](=[O:43])[c:17]([C:20](=[O:21])[NH:22][c:23]2[cH:24][c:25]([F:42])[c:26]([O:29][c:30]3[cH:31][cH:32][n:33][c:34]4[cH:35][c:36]([O:40][CH3:41])[cH:37][cH:38][c:39]34)[cH:27][cH:28]2)[c:18]1[CH3:19]Participants
8
Sources & evidence
- ORD record
- ord-65bf9057aff94ce4a3f45ed9bbe10c08
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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