Ethanol → HCID 69130644, compound
Reaction equation
[CH3:44][CH2:45][OH:46].[CH3:6][CH2:7][O-:8].[CH3:9][O:10][c:11]1[cH:12][c:13]([CH:19]=[C:20]([C:21](=[O:22])[OH:23])[c:24]2[cH:25][cH:26][c:27]([O:30][c:31]3[cH:32][cH:33][c:34]([CH:37]=[CH:38][C:39](=[O:40])[O:41][CH2:42][CH3:43])[cH:35][cH:36]3)[cH:28][cH:29]2)[cH:14][c:15]([O:17][CH3:18])[cH:16]1.[NH2:1][C:2]([NH2:3])=[O:4].[Na+:5]>>[NH:1]([C:2]([NH2:3])=[O:4])[C:39]([CH:38]=[CH:37][c:34]1[cH:33][cH:32][c:31]([O:30][c:27]2[cH:26][cH:25][c:24]([C:20](=[CH:19][c:13]3[cH:12][c:11]([O:10][CH3:9])[cH:16][c:15]([O:17][CH3:18])[cH:14]3)[C:21](=[O:22])[OH:23])[cH:29][cH:28]2)[cH:36][cH:35]1)=[O:40]Participants
6
Sources & evidence
- ORD record
- ord-164b79772b9f4632ba1903ecf44934af
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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