Ethanol → 3-[4-[(4-Hydroxyphenyl)-(2,2,6,6-tetramethyloxan-4-ylidene)methyl]phenyl]prop-2-enoic acid
Reaction equation
[CH3:34][CH2:35][OH:36].[K+:33].[OH-:32].[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([CH:15]=[CH:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:13][cH:14]2)=[C:22]2[CH2:23][C:24]([CH3:30])([CH3:31])[O:25][C:26]([CH3:28])([CH3:29])[CH2:27]2)[cH:6][cH:7]1>>[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([CH:15]=[CH:16][C:17](=[O:18])[OH:19])[cH:13][cH:14]2)=[C:22]2[CH2:23][C:24]([CH3:30])([CH3:31])[O:25][C:26]([CH3:28])([CH3:29])[CH2:27]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-9af508e777f24bcb9b8ba24d878a97d5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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