Acetic Acid → HCID 23014629, compound
Reaction equation
[BH4-:27].[CH3:1][C:2]1=[C:3]([c:10]2[c:11]([CH:16]=[N:17][c:18]3[c:19]([CH3:26])[cH:20][c:21]([CH3:25])[cH:22][c:23]3[CH3:24])[cH:12][cH:13][cH:14][cH:15]2)[CH:4]([CH3:9])[C:5]([CH3:8])=[C:6]1[CH3:7].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[CH3:37][C:38](=[O:39])[OH:40].[Na+:28].[OH2:29]>>[CH3:1][C:2]1=[C:3]([c:10]2[c:11]([CH2:16][NH:17][c:18]3[c:19]([CH3:26])[cH:20][c:21]([CH3:25])[cH:22][c:23]3[CH3:24])[cH:12][cH:13][cH:14][cH:15]2)[CH:4]([CH3:9])[C:5]([CH3:8])=[C:6]1[CH3:7]Participants
7
Sources & evidence
- ORD record
- ord-82490afdbc5a477495f61a39fa445821
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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