Acetic Acid → HCID 23447299, compound
Reaction equation
[C:25]([O:26][BH-:27]([O:28][C:29](=[O:30])[CH3:31])[O:32][C:33](=[O:34])[CH3:35])(=[O:36])[CH3:37].[CH3:1][O:2][CH:3]([CH2:4][NH2:5])[O:6][CH3:7].[CH3:21][C:22](=[O:23])[OH:24].[CH3:39][OH:40].[Na+:38].[n:8]1(-[c:13]2[cH:14][cH:15][c:16]([CH:17]=[O:18])[cH:19][cH:20]2)[cH:9][n:10][cH:11][cH:12]1>>[CH3:1][O:2][CH:3]([CH2:4][NH:5][CH2:17][c:16]1[cH:15][cH:14][c:13](-[n:8]2[cH:9][n:10][cH:11][cH:12]2)[cH:20][cH:19]1)[O:6][CH3:7]Participants
7
Sources & evidence
- ORD record
- ord-2b1dc29ca73a4a9b8df8ada9092a1532
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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