Acetic Acid → HCID 178456758, 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].[CH3:23][O:24][C:25](=[CH2:26])[CH3:27].[CH3:28][C:29](=[O:30])[OH:31].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][N:9]2[CH2:10][CH:11]([CH3:22])[N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[cH:6][cH:7]1.[Na+:45].[Na+:50].[O-:46][C:47]([OH:48])=[O:49]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][N:9]2[CH2:10][CH:11]([CH3:22])[N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[cH:6][cH:7]1)[CH:25]([CH3:26])[CH3:27]Participants
7
Sources & evidence
- ORD record
- ord-f70fae4487db435088ae187fbf4bd007
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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