Ethanol → Alanine, N-[2-methoxy-5-[[[(1E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl]methyl]phenyl]-
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH3:5])[NH:6][c:7]1[c:8]([O:31][CH3:32])[cH:9][cH:10][c:11]([CH2:13][S:14](=[O:15])(=[O:16])[CH:17]=[CH:18][c:19]2[c:20]([O:29][CH3:30])[cH:21][c:22]([O:27][CH3:28])[cH:23][c:24]2[O:25][CH3:26])[cH:12]1)=[O:33].[CH3:36][CH2:37][OH:38].[Na+:35].[OH-:34]>>[O:2]=[C:3]([CH:4]([CH3:5])[NH:6][c:7]1[c:8]([O:31][CH3:32])[cH:9][cH:10][c:11]([CH2:13][S:14](=[O:15])(=[O:16])[CH:17]=[CH:18][c:19]2[c:20]([O:29][CH3:30])[cH:21][c:22]([O:27][CH3:28])[cH:23][c:24]2[O:25][CH3:26])[cH:12]1)[OH:33]Participants
5
Sources & evidence
- ORD record
- ord-d52f8afd794242baa5c7989b33715284
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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