Beta-Alanine → HCID 9969989, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[O:9])[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13].[NH2:18][CH2:19][CH2:20][C:21](=[O:22])[OH:23].[SH:24][CH2:25][C:26](=[O:27])[OH:28].[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]2[N:18]([CH2:19][CH2:20][C:21](=[O:22])[OH:23])[C:26](=[O:27])[CH2:25][S:24]2)[cH:10][c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[c:12]1[OH:13]Participants
5
Sources & evidence
- ORD record
- ord-2488450a17ac4ed18956e772dcf0022e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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