Acetic Acid → HCID 178457079, compound
Reaction equation
[CH3:32][C:33]([CH3:34])=[O:35].[CH3:36][C:37](=[O:38])[OH:39].[Cl:29][CH2:30][Cl:31].[NH2:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:11][C:12]([CH2:13][NH:14][C:15]([c:16]2[cH:17][c:18]([C:23]([CH3:24])([CH3:25])[CH3:26])[c:19]([OH:22])[cH:20][cH:21]2)=[O:27])=[O:28])[CH:6]([C:8](=[O:9])[OH:10])[CH2:7]1.[OH2:40]>>[N:1]([CH:2]1[CH2:3][CH2:4][CH:5]([NH:11][C:12]([CH2:13][NH:14][C:15]([c:16]2[cH:17][c:18]([C:23]([CH3:24])([CH3:25])[CH3:26])[c:19]([OH:22])[cH:20][cH:21]2)=[O:27])=[O:28])[CH:6]([C:8](=[O:9])[OH:10])[CH2:7]1)([CH:33]([CH3:32])[CH3:34])[CH3:36]Participants
6
Sources & evidence
- ORD record
- ord-c7cbcc7c8ba545429f927b28a33945dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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