Ethanol → HCID 22228199, compound
Reaction equation
[CH2:1]([CH3:2])[CH:3]([N:4]([C:5](=[O:6])[c:7]1[c:8]([CH3:22])[n:9][n:10](-[c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[cH:11]1)[c:23]1[cH:24][c:25]([C:35]#[N:36])[c:26]([O:29][CH2:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:27][cH:28]1)[C:37](=[O:38])[OH:39].[CH3:42][CH2:43][OH:44].[Na+:41].[OH-:40]>>[CH2:3]([N:4]([C:5](=[O:6])[c:7]1[c:8]([CH3:22])[n:9][n:10](-[c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[cH:11]1)[c:23]1[cH:24][c:25]([C:35]#[N:36])[c:26]([O:29][CH2:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:27][cH:28]1)[C:37](=[O:38])[OH:39]Participants
5
Sources & evidence
- ORD record
- ord-2a3f3902f39f4b368176e83d962cbf34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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