Acetic Acid → HCID 68476364, compound
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH3:22][C:23](=[O:24])[OH:25].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH:20]=[O:21])[c:6](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[nH:7][c:8]2[c:9]([N+:11](=[O:12])[O-:13])[cH:10]1.[Cl:47][CH2:48][Cl:49].[Na+:46].[O:26]=[C:27]1[NH:28][CH2:29][CH2:30][NH:31][CH2:32]1.[OH2:50]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH2:20][N:31]3[CH2:30][CH2:29][NH:28][C:27](=[O:26])[CH2:32]3)[c:6](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[nH:7][c:8]2[c:9]([N+:11](=[O:12])[O-:13])[cH:10]1Participants
8
Sources & evidence
- ORD record
- ord-1b77aab439524e9d929820a41cea168d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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