Acetic Acid → 2-(1-Benzothiophen-5-yl)-3-methylbutanoic acid
Reaction equation
[CH3:21][C:22](=[O:23])[OH:24].[CH:1]([CH3:2])([CH3:3])[CH:4]([C:5]#[N:6])[c:7]1[cH:8][c:9]2[c:10]([s:11][cH:12][cH:13]2)[cH:14][cH:15]1.[OH2:25].[S:16]([OH:17])(=[O:18])(=[O:19])[OH:20]>>[CH:1]([CH3:2])([CH3:3])[CH:4]([C:5]([OH:17])=[O:25])[c:7]1[cH:8][c:9]2[c:10]([s:11][cH:12][cH:13]2)[cH:14][cH:15]1Participants
5
Sources & evidence
- ORD record
- ord-87bbc974385c405d9d5f64c9919e9f8b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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