Acetic Acid → HCID 178485637, compound
Reaction equation
[C:14]([CH3:15])([CH3:16])([CH3:17])[O:18][C:19]([NH:20][CH:21]([CH2:22][c:23]1[cH:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]2[cH:31][cH:32]1)[CH:33]=[O:34])=[O:35].[C:36]([BH3-:37])#[N:38].[C:40](=[O:41])([O-:42])[OH:43].[CH3:1][NH:2][C:3]([CH:4]([NH2:5])[CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)=[O:13].[CH3:45][OH:46].[CH3:48][C:49](=[O:50])[OH:51].[Na+:39].[Na+:44].[OH2:47]>>[CH3:1][NH:2][C:3]([CH:4]([NH:5][CH2:33][CH:21]([NH:20][C:19]([O:18][C:14]([CH3:15])([CH3:16])[CH3:17])=[O:35])[CH2:22][c:23]1[cH:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]2[cH:31][cH:32]1)[CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)=[O:13]Participants
9
Sources & evidence
- ORD record
- ord-aa97d63a12d94c73a666e6601eefe7b4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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