Acetic Acid → HCID 21999275, compound
Reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6](=[O:7])[c:8]1[c:9]([Cl:15])[cH:10][c:11]([NH2:14])[cH:12][cH:13]1)[CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[c:26]2[c:27]([Cl:33])[cH:28][cH:29][cH:30][c:31]2[Cl:32])[cH:21][cH:22]1)=[O:34].[CH3:38][C:39](=[O:40])[OH:41].[Li+:36].[OH-:35].[OH2:37].[OH2:47]>>[O:2]=[C:3]([CH:4]([NH:5][C:6](=[O:7])[c:8]1[c:9]([Cl:15])[cH:10][c:11]([NH2:14])[cH:12][cH:13]1)[CH2:16][c:17]1[cH:18][cH:19][c:20]([NH:23][C:24](=[O:25])[c:26]2[c:27]([Cl:33])[cH:28][cH:29][cH:30][c:31]2[Cl:32])[cH:21][cH:22]1)[OH:34]Participants
7
Sources & evidence
- ORD record
- ord-abf723f60a5f4413971c69721846899e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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