Acetic Acid → HCID 58614658, compound
Reaction equation
[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[C:46]([OH:47])(=[O:48])[CH3:49].[Cl:2][c:3]1[c:4](-[c:26]2[n:27][cH:28][cH:29][cH:30][cH:31]2)[cH:5][c:6]([NH:9][C:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[C:19](=[O:24])[CH2:20][NH:21][CH2:22][CH2:23]3)[cH:15][cH:16]2)=[O:25])[cH:7][cH:8]1.[ClH:1].[Na+:45].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54]>>[Cl:2][c:3]1[c:4](-[c:26]2[n:27][cH:28][cH:29][cH:30][cH:31]2)[cH:5][c:6]([NH:9][C:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[C:19](=[O:24])[CH2:20][N:21]([CH3:32])[CH2:22][CH2:23]3)[cH:15][cH:16]2)=[O:25])[cH:7][cH:8]1Participants
7
Sources & evidence
- ORD record
- ord-a120d571209a4c999a0fbc2410360e73
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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