Water → HCID 25174781, compound
Reaction equation
[CH3:31][N:32]([CH2:33][CH2:34][CH2:35][NH2:36])[CH3:37].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:49][CH2:50][O:51][C:52]([CH3:53])=[O:54].[Cl:46][CH2:47][Cl:48].[OH2:45].[c:1]1(-[c:7]2[n:8][cH:9][cH:10][c:11](-[c:13]3[cH:14][n:15][c:16]4[n:17]3[n:18][cH:19][c:20](-[c:22]3[cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29][cH:30]3)[cH:21]4)[cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][cH:9][cH:10][c:11](-[c:13]3[cH:14][n:15][c:16]4[n:17]3[n:18][cH:19][c:20](-[c:22]3[cH:23][c:24]([C:25](=[O:26])[NH:36][CH2:35][CH2:34][CH2:33][N:32]([CH3:31])[CH3:37])[cH:28][cH:29][cH:30]3)[cH:21]4)[cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
7
Sources & evidence
- ORD record
- ord-80e993ebcd0c48e8bac7e02ddaf3926d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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