Acetic Acid → HCID 66887136, compound
Reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:18]([CH:19]([CH3:20])[CH3:21])[NH2:22])[n:10][c:11]2[c:12]1[cH:13][cH:14][c:15]([CH3:17])[cH:16]2.[CH3:52][C:53](=[O:54])[OH:55].[Cl:56][CH2:57][Cl:58].[Na+:51].[O:23]=[C:24]1[N:25]([CH2:34][CH2:35][CH:36]=[O:37])[C:26](=[O:33])[c:27]2[cH:28][cH:29][cH:30][cH:31][c:32]21>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:18]([CH:19]([CH3:20])[CH3:21])[NH:22][CH2:36][CH2:35][CH2:34][N:25]2[C:24](=[O:23])[c:32]3[c:27]([cH:28][cH:29][cH:30][cH:31]3)[C:26]2=[O:33])[n:10][c:11]2[c:12]1[cH:13][cH:14][c:15]([CH3:17])[cH:16]2Participants
7
Sources & evidence
- ORD record
- ord-0d6f95f50d6f4d55920c6f1bb75d5208
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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