Methyl beta-alanate → HCID 54698207, compound
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH2:6])=[O:7].[Cl:8][c:9]1[cH:10][c:11]([CH2:12][N:13]([C:14](=[O:15])[C:16]2=[C:20]([OH:21])[C:19](=[O:22])[N:18]([CH3:23])[CH2:17]2)[CH3:24])[cH:25][cH:26][c:27]1[Cl:28]>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][N:6]1[CH2:17][C:16]([C:14]([N:13]([CH2:12][c:11]2[cH:10][c:9]([Cl:8])[c:27]([Cl:28])[cH:26][cH:25]2)[CH3:24])=[O:15])=[C:20]([OH:21])[C:19]1=[O:22])=[O:7]Participants
3
Sources & evidence
- ORD record
- ord-5db8433a70d048e28aa3328e2e376708
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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