Ethanol → HCID 77271744, compound
Reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][c:6]1[n:7][c:8](-[c:11]2[cH:12][c:13]([N:17]3[C:18](=[O:33])[c:19]4[c:20]([n:27][c:28]([S:31][CH3:32])[n:29][cH:30]4)[N:21]4[CH2:22][CH2:23][CH2:24][CH:25]4[CH2:26]3)[cH:14][cH:15][cH:16]2)[n:9][o:10]1.[CH3:36][CH2:37][OH:38].[Na+:35].[OH-:34]>>[OH:4][CH2:5][c:6]1[n:7][c:8](-[c:11]2[cH:12][c:13]([N:17]3[C:18](=[O:33])[c:19]4[c:20]([n:27][c:28]([S:31][CH3:32])[n:29][cH:30]4)[N:21]4[CH2:22][CH2:23][CH2:24][CH:25]4[CH2:26]3)[cH:14][cH:15][cH:16]2)[n:9][o:10]1Participants
5
Sources & evidence
- ORD record
- ord-99a459a3ccc34f3ba8abd0a168cb3c2c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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