Ethanol → HCID 22467251, compound
Reaction equation
[CH2:1]([S:2][P:3]([O-:4])([O:5][CH2:6][CH3:7])=[S:8])[CH3:9].[CH3:51][CH2:52][OH:53].[NH2:47][CH2:48][CH2:49][NH2:50].[O:10]1[CH2:11][O:12][c:13]2[c:14]1[cH:15][cH:16][c:17]([CH:19]([C:20](=[O:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]1[cH:27][cH:28][c:29]([CH:32]([CH3:33])[CH3:34])[cH:30][cH:31]1)[c:35]1[cH:36][n:37]([CH3:46])[c:38]3[cH:39][c:40]([C:44]#[N:45])[cH:41][cH:42][c:43]13)[cH:18]2.[OH2:54]>>[O:10]1[CH2:11][O:12][c:13]2[c:14]1[cH:15][cH:16][c:17]([CH:19]([C:20](=[O:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]1[cH:27][cH:28][c:29]([CH:32]([CH3:33])[CH3:34])[cH:30][cH:31]1)[c:35]1[cH:36][n:37]([CH3:46])[c:38]3[cH:39][c:40]([C:44]4=[N:45][CH2:49][CH2:48][NH:47]4)[cH:41][cH:42][c:43]13)[cH:18]2Participants
6
Sources & evidence
- ORD record
- ord-2bbbd0acd09947798e4c45eb293d0e4c
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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