Acetic Acid → HCID 67086690, compound
Reaction equation
[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27]([CH2:28][CH2:29][NH2:30])=[O:31].[C:43]([O:44][BH-:45]([O:46][C:47](=[O:48])[CH3:49])[O:50][C:51](=[O:52])[CH3:53])(=[O:54])[CH3:55].[CH3:1][O:2][C:3]([CH:4]([CH3:5])[N:6]([CH2:7][CH:8]=[O:9])[C:10](=[O:11])[O:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)=[O:20].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][C:40](=[O:41])[OH:42].[Cl:57][CH2:58][Cl:59].[ClH:21].[Na+:56]>>[C:3]1(=[O:20])[CH:4]([CH3:5])[N:6]([C:10](=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:7][CH2:8][N:30]1[CH2:29][CH2:28][C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:31]Participants
9
Sources & evidence
- ORD record
- ord-76d57e574fcf40d0a898389f8e6cecc9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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