Acetic Acid → HCID 57874423, compound
Reaction equation
[CH2:1]=[O:2].[CH3:36][C:37](=[O:38])[OH:39].[NH3:40].[O:3]=[C:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[n:10][n:11][n:12]([CH:14]2[CH2:15][NH:16][CH2:17][CH2:18]2)[cH:13]1)[N:19]1[CH2:20][CH2:21][CH:22]([O:25][c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)[CH2:23][CH2:24]1.[OH2:41].[Zn:42]>>[O:3]=[C:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[n:10][n:11][n:12]([CH:14]2[CH2:15][N:16]([CH3:36])[CH2:17][CH2:18]2)[cH:13]1)[N:19]1[CH2:20][CH2:21][CH:22]([O:25][c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)[CH2:23][CH2:24]1Participants
7
Sources & evidence
- ORD record
- ord-a1d7558ee4ce4b6290b51ebb76db02ed
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…