Ethanol → HCID 20536501, compound
Reaction equation
[CH3:29][CH2:30][OH:31].[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[O-:7])[cH:8][cH:9][c:10]1[NH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27].[Na+:28].[OH2:50].[S:32]([O:33][CH:43]([C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH3:49])([c:34]1[cH:35][cH:36][c:37]([CH3:38])[cH:39][cH:40]1)(=[O:41])=[O:42]>>[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[O:7][CH:43]([C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH3:49])[cH:8][cH:9][c:10]1[NH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27]Participants
6
Sources & evidence
- ORD record
- ord-1c7c190bed544675860f58515493a14e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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