Ethanol → HCID 57555561, compound
Reaction equation
[CH3:47][CH2:48][OH:49].[F:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:41](=[O:42])[OH:43])[c:12](=[O:40])[c:13]3[cH:14][c:15]([F:39])[c:16]([N:19]4[CH2:20][CH:21]5[C:22]([CH2:27][N:28]6[C:29](=[O:30])[c:31]7[c:32]([cH:33][cH:34][cH:35][cH:36]7)[C:37]6=[O:38])=[N:23][O:24][CH:25]5[CH2:26]4)[n:17][c:18]23)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[NH2:45][NH2:46].[OH2:44]>>[F:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:41](=[O:42])[OH:43])[c:12](=[O:40])[c:13]3[cH:14][c:15]([F:39])[c:16]([N:19]4[CH2:20][CH:21]5[C:22]([CH2:27][NH2:28])=[N:23][O:24][CH:25]5[CH2:26]4)[n:17][c:18]23)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-73bb5ebc16234e62b83cbcec6b1c816a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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