Acetic Acid → 2-(3,4-Dihydro-3-oxo-2H-benzo[b][1,4]oxazin-6-yl)propanoic acid
Reaction equation
[CH3:22][C:23](=[O:24])[OH:25].[CH3:26][CH2:27][OH:28].[Na+:20].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:8][cH:9][c:10]([CH:12]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[CH3:18])[cH:11]2)[O:6][CH2:7]1.[OH-:19].[OH2:21]>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:8][cH:9][c:10]([CH:12]([C:13](=[O:14])[OH:15])[CH3:18])[cH:11]2)[O:6][CH2:7]1Participants
7
Sources & evidence
- ORD record
- ord-a9eefbfa91e74210a7a3931ff86985d6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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