Water → HCID 10460715, compound
Reaction equation
[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[Cl:10][c:11]1[cH:12][cH:13][c:14]([CH2:15][NH:16][C:17](=[O:18])[c:19]2[c:20](=[O:37])[c:21]3[c:22]([n:23]([CH2:25][C:26](=[O:27])[N:28]([CH3:29])[O:30][CH3:31])[cH:24]2)[cH:32][c:33]([CH2:35][Cl:36])[s:34]3)[cH:38][cH:39]1.[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:50].[o:40]1[c:41]([CH:45]([CH2:46][NH:47][CH3:48])[OH:49])[cH:42][cH:43][cH:44]1>>[Cl:10][c:11]1[cH:12][cH:13][c:14]([CH2:15][NH:16][C:17](=[O:18])[c:19]2[c:20](=[O:37])[c:21]3[c:22]([n:23]([CH2:25][C:26](=[O:27])[N:28]([CH3:29])[O:30][CH3:31])[cH:24]2)[cH:32][c:33]([CH2:35][N:47]([CH2:46][CH:45]([c:41]2[o:40][cH:44][cH:43][cH:42]2)[OH:49])[CH3:48])[s:34]3)[cH:38][cH:39]1Participants
6
Sources & evidence
- ORD record
- ord-ba89e6b8885145a59f5fcef3c0a75928
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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