Ethanol → HCID 10053886, compound
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][N:15]([c:16]2[s:17][cH:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]3)[n:20]2)[c:32]2[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]2)[cH:12][cH:13]1)=[O:39])=[O:40].[CH3:43][CH2:44][OH:45].[Na+:42].[OH-:41]>>[O:2]=[C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][N:15]([c:16]2[s:17][cH:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]3)[n:20]2)[c:32]2[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]2)[cH:12][cH:13]1)=[O:39])[OH:40]Participants
5
Sources & evidence
- ORD record
- ord-35eecf00d80f463caf17642c1ae17311
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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