Acetic Acid → HCID 12937946, compound
Reaction equation
[C:21]([O:22][BH-:23]([O:24][C:25](=[O:26])[CH3:27])[O:28][C:29](=[O:30])[CH3:31])(=[O:32])[CH3:33].[CH3:13][C:14](=[O:15])[OH:16].[CH:17]([CH2:18][CH3:19])=[O:20].[Cl:35][CH2:36][Cl:37].[Na+:34].[OH2:38].[c:1]1([CH:7]2[CH2:8][NH:9][CH2:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][N:9]([CH2:17][CH2:18][CH3:19])[CH2:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
8
Sources & evidence
- ORD record
- ord-d8068503d13c4408a5d79dcc81aa27d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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