Acetic Acid → HCID 12851862, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][cH:11][c:12]3[c:13]([CH2:18][C:19]#[N:20])[cH:14][cH:15][cH:16][c:17]23)[cH:6][cH:7]1.[CH3:21][C:22]([OH:23])=[O:24].[Na+:31].[OH-:30].[OH2:32].[S:25](=[O:26])(=[O:27])([OH:28])[OH:29]>>[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][cH:11][c:12]3[c:13]([CH2:21][C:22]([OH:23])=[O:24])[cH:14][cH:15][cH:16][c:17]23)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-7f1f63b3c38643d396c30dedb880b008
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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