3-Ethyl-4-hydroxy-5-methyl-benzoic acid tert-butyl ester → 3-Ethyl-4-[2-hydroxy-3-(2-hydroxy-acetylamino)-propoxy]-5-methyl-benzoic acid tert. butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([c:7]1[cH:8][c:9]([CH2:15][CH3:16])[c:10]([OH:14])[c:11]([CH3:13])[cH:12]1)=[O:17].[CH2:18]([c:19]1[cH:20][c:21]([C:22](=[NH:32])[NH:33][OH:34])[cH:35][c:36]([CH3:37])[c:38]1[O:39][CH2:23][CH:24]([CH2:25][NH:26][C:27]([CH2:28][OH:29])=[O:30])[OH:31])[CH3:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([c:7]1[cH:8][c:9]([CH2:15][CH3:16])[c:10]([O:14][CH2:23][CH:24]([CH2:25][NH:26][C:27]([CH2:28][OH:29])=[O:30])[OH:31])[c:11]([CH3:13])[cH:12]1)=[O:17]Participants
3
Sources & evidence
- ORD record
- ord-8f09533e2999443c91c06eeed1b42c0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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