Ethanol → HCID 14803010, compound
Reaction equation
[CH3:64][CH2:65][OH:66].[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5][CH:6]1[O:7][CH:8]1[CH:9]([O:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[CH:18]([O:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH:27]([O:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[CH:36]([CH2:38][O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[S:37]1.[c:47]1([CH3:48])[cH:49][cH:50][c:51]([S:52]([O-:53])(=[O:54])=[O:55])[cH:56][cH:57]1.[nH+:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1>>[OH:7][CH:8]1[CH:9]([O:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[CH:18]([O:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH:27]([O:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[CH:36]([CH2:38][O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[S:37]1Participants
5
Sources & evidence
- ORD record
- ord-98ac1b814a9e4a949a303725bd06af12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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