Ethanol → HCID 58812092, compound
Reaction equation
[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH3:39][CH2:40][OH:41].[c:1]1([S:7](=[O:8])(=[O:9])[CH2:10][c:11]2[cH:12][c:13]([O:14][CH2:15][CH2:16][O:17][S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][c:24]([CH3:27])[cH:25][cH:26]3)[cH:28][cH:29][c:30]2[N+:31]([O-:32])=[O:33])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[CH2:10][c:11]2[cH:12][c:13]([O:14][CH2:15][CH2:16][O:17][S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][c:24]([CH3:27])[cH:25][cH:26]3)[cH:28][cH:29][c:30]2[NH2:31])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-0944c466eb75499ca72805e3bf88cab4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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