2-(Dimethylamino)ethanol → HCID 178424025, compound
Reaction equation
[CH3:28][N:29]([CH2:30][CH2:31][OH:32])[CH3:33].[O:53]=[C:54]([O:55][CH2:56][CH3:57])[N:58]=[N:59][C:60]([O:61][CH2:62][CH3:63])=[O:64].[OH:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](-[c:21]3[cH:22][cH:23][c:24]([CH3:27])[cH:25][cH:26]3)[c:11]([C:13](=[O:14])[NH:15][c:16]3[s:17][cH:18][cH:19][n:20]3)[n:12]2)[cH:6][cH:7]1.[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[O:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](-[c:21]3[cH:22][cH:23][c:24]([CH3:27])[cH:25][cH:26]3)[c:11]([C:13](=[O:14])[NH:15][c:16]3[s:17][cH:18][cH:19][n:20]3)[n:12]2)[cH:6][cH:7]1)[CH2:31][CH2:30][N:29]([CH3:28])[CH3:33]Participants
5
Sources & evidence
- ORD record
- ord-638299d0434b4089b302b7c5cc4ccb6e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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