Methanol → [4-(5-tert-Butyl-3-hydroxymethyl-4-isopropoxy-2-methyl-phenylethynyl)-phenyl]-acetic acid methyl ester
Reaction equation
[BH4-:31].[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[c:14]([CH3:29])[c:15]([CH:27]=[O:28])[c:16]([O:23][CH:24]([CH3:25])[CH3:26])[c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:18]2)[cH:9][cH:10]1)=[O:30].[CH3:33][OH:34].[Na+:32]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[c:14]([CH3:29])[c:15]([CH2:27][OH:28])[c:16]([O:23][CH:24]([CH3:25])[CH3:26])[c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:18]2)[cH:9][cH:10]1)=[O:30]Participants
5
Sources & evidence
- ORD record
- ord-2db665d38a144a1ba6658528fc0537c9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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