Acetic Acid → 3-(2-(1-Benzothiophen-5-yl)ethoxy)propionic acid
Reaction equation
[CH3:23][CH2:24][O:25][C:26](=[O:27])[CH3:28].[CH3:29][C:30]([OH:31])=[O:32].[OH2:17].[S:18](=[O:19])(=[O:20])([OH:21])[OH:22].[s:1]1[cH:2][cH:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH2:10][CH2:11][O:12][CH2:13][CH2:14][C:15]#[N:16])[cH:9]2>>[s:1]1[cH:2][cH:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH2:10][CH2:11][O:12][CH2:13][CH2:29][C:30]([OH:31])=[O:32])[cH:9]2Participants
6
Sources & evidence
- ORD record
- ord-9d05f95b52c44e9abf7be2da239c3e7e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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