Acetic Acid → HCID 178453857, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][S:11][CH:12]([CH2:13][N+:14]([O-:15])=[O:16])[c:17]1[s:18][cH:19][cH:20][cH:21]1)[C:22](=[O:23])[OH:24].[CH3:27][C:28](=[O:29])[OH:30].[H:25][H:26]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][S:11][CH:12]([CH2:13][NH2:14])[c:17]1[s:18][cH:19][cH:20][cH:21]1)[C:22](=[O:23])[OH:24]Participants
4
Sources & evidence
- ORD record
- ord-3b01cfdfaf3d427393c118ee10048933
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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