Ethanol → 6-(4-Acetyl-3-hydroxy-2-propylphenoxy)-6-(4-benzylphenyl)hexanoic acid
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:37])[c:6]([CH2:34][CH2:35][CH3:36])[c:7]([O:8][CH:9]([CH2:10][CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:19]2[cH:20][cH:21][c:22]([CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[cH:23][cH:24]2)[cH:32][cH:33]1.[CH3:40][CH2:41][OH:42].[Na+:39].[OH-:38]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:37])[c:6]([CH2:34][CH2:35][CH3:36])[c:7]([O:8][CH:9]([CH2:10][CH2:11][CH2:12][CH2:13][C:14](=[O:15])[OH:16])[c:19]2[cH:20][cH:21][c:22]([CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[cH:23][cH:24]2)[cH:32][cH:33]1Participants
5
Sources & evidence
- ORD record
- ord-b9477755713349c8b926f1af34f2fd6d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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