Ethyl 5-bromovalerate → HCID 58213506, compound
Reaction equation
[Br:27][CH2:28][CH2:29][CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36].[NH2:1][c:2]1[n:3][c:4]2[c:5]([c:6]3[cH:7][c:8]([CH2:12][CH2:13][c:14]4[c:15]([CH3:21])[cH:16][c:17]([OH:20])[cH:18][cH:19]4)[cH:9][n:10][c:11]13)[cH:22][cH:23][c:24]([CH3:26])[cH:25]2>>[NH2:1][c:2]1[n:3][c:4]2[c:5]([c:6]3[cH:7][c:8]([CH2:12][CH2:13][c:14]4[c:15]([CH3:21])[cH:16][c:17]([O:20][CH2:28][CH2:29][CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[cH:18][cH:19]4)[cH:9][n:10][c:11]13)[cH:22][cH:23][c:24]([CH3:26])[cH:25]2Participants
3
Sources & evidence
- ORD record
- ord-426f229e252e4ac18e81566a279b0c45
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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