DL-alanine → 2-[[7-(4-Fluorophenoxy)-4-hydroxyisoquinoline-3-carbonyl]amino]propanoic acid
Reaction equation
[CH2:1]([O:2][C:6](=[O:7])[c:8]1[n:9][cH:10][c:11]2[cH:12][c:13]([O:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:14][cH:15][c:16]2[c:17]1[OH:18])[CH2:3][CH2:4][CH3:5].[CH3:33][OH:34].[NH2:27][CH:28]([CH3:29])[C:30](=[O:31])[OH:32]>>[C:6](=[O:7])([c:8]1[n:9][cH:10][c:11]2[cH:12][c:13]([O:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:14][cH:15][c:16]2[c:17]1[OH:18])[NH:27][CH:28]([CH3:29])[C:30](=[O:31])[OH:32]Participants
4
Sources & evidence
- ORD record
- ord-b96b0847dfca411e8cc74018ef1a1cbd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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