Water → HCID 70029818, compound
Reaction equation
[C:16]([CH3:17])([CH3:18])([CH3:19])[O:20][C:21]([NH:22][CH:23]([CH2:24][Br:25])[CH2:26][c:27]1[cH:28][n:29][cH:30][cH:31][cH:32]1)=[O:33].[CH2:45]([O:46][C:47](=[O:48])[CH3:49])[CH3:50].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[CH:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[cH:6][cH:7]1.[N:34]12[CH2:35][CH2:36][CH2:37][N:38]=[C:39]1[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]2.[OH2:56]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[CH:10]2[CH2:11][CH2:12][N:13]([CH2:24][CH:23]([NH:22][C:21]([O:20][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:33])[CH2:26][c:27]3[cH:28][n:29][cH:30][cH:31][cH:32]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-a2dc70b8e49d4cfe9cbbb49be4540f9d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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