Acetic Acid → HCID 54000860, compound
Reaction equation
[BH3:20].[CH3:17][S:18][CH3:19].[CH3:21][C:22](=[O:23])[OH:24].[CH3:36][OH:37].[CH:32]([Cl:33])([Cl:34])[Cl:35].[H:25][H:26].[NH2:1][CH2:2][CH:3]([CH2:4][O:5][c:6]1[s:7][c:8]([C:11]([N:12]([CH3:13])[CH3:14])=[O:15])[cH:9][n:10]1)[OH:16].[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[OH2:38]>>[NH2:1][CH2:2][CH:3]([CH2:4][O:5][c:6]1[s:7][c:8]([CH2:11][N:12]([CH3:13])[CH3:14])[cH:9][n:10]1)[OH:16]Participants
10
Sources & evidence
- ORD record
- ord-1f9b9149e10d428d9a1be233a2ff1dd6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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