Water → HCID 22903527, compound
Reaction equation
[CH3:36][N:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:35]1)[CH:7]([O:30][CH2:31][C:32](=[O:33])[OH:34])[CH2:8][CH2:9][CH2:10][N:11]2[C:12]([c:13]1[cH:14][n:15][c:16]([NH:19][C:20]([c:21]2[c:22]([CH3:27])[cH:23][cH:24][cH:25][cH:26]2)=[O:28])[cH:17][cH:18]1)=[O:29].[Cl:51][CH2:52][Cl:53].[OH2:50]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:35]1)[CH:7]([O:30][CH2:31][C:32](=[O:33])[N:40]1[CH2:39][CH2:38][N:37]([CH3:36])[CH2:42][CH2:41]1)[CH2:8][CH2:9][CH2:10][N:11]2[C:12]([c:13]1[cH:14][n:15][c:16]([NH:19][C:20]([c:21]2[c:22]([CH3:27])[cH:23][cH:24][cH:25][cH:26]2)=[O:28])[cH:17][cH:18]1)=[O:29]Participants
6
Sources & evidence
- ORD record
- ord-a0c6d741bc90481e8493df45b5629f89
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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