Acetic Acid → HCID 68833529, compound
Reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH:24]=[O:25])[cH:21][cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16].[CH3:33][C:34](=[O:35])[OH:36].[Cl:51][CH2:52][Cl:53].[NH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[Na+:50]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH2:24][NH:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:21][cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16]Participants
7
Sources & evidence
- ORD record
- ord-18bbd4746b9346c6add2c08e6322352b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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