Water → HCID 178498241, compound
Reaction equation
[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[F:1][c:2]1[c:3]([CH2:19][C:20](=[O:21])[OH:22])[cH:4][cH:5][c:6]2[n:7][c:8]([NH:11][c:12]3[c:13]([CH3:18])[cH:14][cH:15][cH:16][cH:17]3)[o:9][c:10]12.[F:23][CH:24]1[CH2:25][CH:26]([CH2:29][O:30][c:31]2[cH:32][cH:33][c:34]([C:35](=[O:36])[O:37][CH3:38])[cH:39][cH:40]2)[NH:27][CH2:28]1.[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[OH2:63].[OH:41][n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[n:49][n:50]1>>[F:1][c:2]1[c:3]([CH2:19][C:20](=[O:21])[N:27]2[CH:26]([CH2:29][O:30][c:31]3[cH:32][cH:33][c:34]([C:35](=[O:36])[O:37][CH3:38])[cH:39][cH:40]3)[CH2:25][CH:24]([F:23])[CH2:28]2)[cH:4][cH:5][c:6]2[n:7][c:8]([NH:11][c:12]3[c:13]([CH3:18])[cH:14][cH:15][cH:16][cH:17]3)[o:9][c:10]12Participants
7
Sources & evidence
- ORD record
- ord-22d96de9fbe144958229ac5251c390f9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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