Acetic Acid → HCID 10128112, compound
Reaction equation
[C:36](#[N:37])[BH3-:38].[CH3:30][NH2:31].[CH3:32][C:33](=[O:34])[OH:35].[CH3:45][OH:46].[Cl:1][c:2]1[c:3]([S:9](=[O:10])(=[O:11])[NH:12][c:13]2[n:14][cH:15][c:16]([Cl:29])[n:17][c:18]2[O:19][CH2:20][c:21]2[cH:22][c:23]([CH:27]=[O:28])[cH:24][cH:25][cH:26]2)[cH:4][cH:5][cH:6][c:7]1[Cl:8].[Na+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH2:47]>>[Cl:1][c:2]1[c:3]([S:9](=[O:10])(=[O:11])[NH:12][c:13]2[n:14][cH:15][c:16]([Cl:29])[n:17][c:18]2[O:19][CH2:20][c:21]2[cH:22][c:23]([CH2:27][NH:37][CH3:36])[cH:24][cH:25][cH:26]2)[cH:4][cH:5][cH:6][c:7]1[Cl:8]Participants
9
Sources & evidence
- ORD record
- ord-fd73a1e791d34cb6b6f9457e719b8734
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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