Acetic Acid → HCID 86760861, compound
Reaction equation
[C:36]([OH:37])(=[O:38])[CH3:39].[N:1]1([CH2:6][CH2:7][CH2:8][CH2:9][NH:10][C:11](=[O:12])[c:13]2[n:14][cH:15][cH:16][c:17]([O:19][c:20]3[cH:21][cH:22][c:23]([OH:26])[cH:24][cH:25]3)[cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Na+:35].[O-:31][C:32]([OH:33])=[O:34].[OH:27][N+:28]([O-:29])=[O:30]>>[N:1]1([CH2:6][CH2:7][CH2:8][CH2:9][NH:10][C:11](=[O:12])[c:13]2[n:14][cH:15][cH:16][c:17]([O:19][c:20]3[cH:21][c:22]([N+:28](=[O:27])[O-:29])[c:23]([OH:26])[cH:24][cH:25]3)[cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
6
Sources & evidence
- ORD record
- ord-9cbba0cf3bcb4cf0aa0ccaf39f7e8d43
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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