Water → HCID 21486984, compound
Reaction equation
[CH2:47]([O:48][CH2:49][CH3:50])[CH3:51].[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:22][O:23][c:24]1[cH:25][c:26]2[c:31]([cH:32][c:33]1[O:34][CH3:35])[CH:30]([c:36]1[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]1)[N:29]([C:44](=[O:45])[Cl:46])[CH2:28][CH2:27]2.[CH:18]([Cl:19])([Cl:20])[Cl:21].[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][NH2:7])[CH:8]([CH3:9])[CH3:10].[OH2:52]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][NH:7][C:44]([N:29]1[CH2:28][CH2:27][c:26]2[cH:25][c:24]([O:23][CH3:22])[c:33]([O:34][CH3:35])[cH:32][c:31]2[CH:30]1[c:36]1[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]1)=[O:45])[CH:8]([CH3:9])[CH3:10]Participants
7
Sources & evidence
- ORD record
- ord-34260c12478f47b79d31759607c58e56
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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