Acetic Acid → HCID 18328914, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH:14]=[O:15])[CH2:12][CH2:13]1.[C:28]([BH3-:29])#[N:30].[C:32]([OH:33])(=[O:34])[CH3:35].[CH3:36][OH:37].[Na+:31].[n:16]1[cH:17][cH:18][c:19]([CH:22]2[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]2)[cH:20][cH:21]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][N:25]2[CH2:24][CH2:23][CH:22]([c:19]3[cH:18][cH:17][n:16][cH:21][cH:20]3)[CH2:27][CH2:26]2)[CH2:12][CH2:13]1Participants
7
Sources & evidence
- ORD record
- ord-2110999363424873ad69ba4390860586
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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