Acetic Acid → HCID 54370431, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:16])[NH:11][C:12]([CH3:14])([CH3:15])[CH2:13]2)[cH:17][c:18]([C:21]([CH3:22])([CH3:23])[CH3:24])[c:19]1[OH:20].[C:33]([OH:34])(=[O:35])[CH3:36].[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Cl:25][S:26](=[O:27])(=[O:28])[N:29]=[C:30]=[O:31].[OH2:32]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:16])[N:11]([C:30]([NH2:29])=[O:31])[C:12]([CH3:14])([CH3:15])[CH2:13]2)[cH:17][c:18]([C:21]([CH3:22])([CH3:23])[CH3:24])[c:19]1[OH:20]Participants
6
Sources & evidence
- ORD record
- ord-35ddf154f7814d298163d679a5cd3b23
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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