2-[2-(3,5-Difluoro-phenyl)-acetylamino]-pentanoic acid → HCID 178449437, compound
Reaction equation
[F:19][c:20]1[cH:21][c:22]([CH2:27][C:28](=[O:29])[NH:30][CH:31]([C:32](=[O:33])[OH:34])[CH2:35][CH2:36][CH3:37])[cH:23][c:24]([F:26])[cH:25]1.[N+:1]([O-:2])(=[O:3])[c:4]1[n:5][cH:6][n:7]([CH:9]2[CH:10]([CH2:13][N:14]3[CH2:15][CH2:16][CH2:17][CH2:18]3)[CH2:11][CH2:12]2)[cH:8]1>>[NH:1]([c:4]1[n:5][cH:6][n:7]([CH:9]2[CH:10]([CH2:13][N:14]3[CH2:15][CH2:16][CH2:17][CH2:18]3)[CH2:11][CH2:12]2)[cH:8]1)[C:32]([CH:31]([NH:30][C:28]([CH2:27][c:22]1[cH:21][c:20]([F:19])[cH:25][c:24]([F:26])[cH:23]1)=[O:29])[CH2:35][CH2:36][CH3:37])=[O:33]Participants
3
Sources & evidence
- ORD record
- ord-c85ac7bec12a4fa0b75f7b74193387aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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