Acetic Acid → HCID 59645218, compound
Reaction equation
[CH3:1][O-:2].[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][OH:40].[CH3:4][N:5]([c:6]1[c:7]2[cH:8][cH:9][cH:10][n:11][c:12]2[c:13]([O:20][S:21]([c:22]2[cH:23][cH:24][c:25]([CH3:26])[cH:27][cH:28]2)(=[O:29])=[O:30])[c:14]([C:16](=[O:17])[O:18][CH3:19])[n:15]1)[S:31](=[O:32])(=[O:33])[CH3:34].[Na+:3].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[CH3:4][N:5]([c:6]1[c:7]2[cH:8][cH:9][cH:10][n:11][c:12]2[c:13]([OH:20])[c:14]([C:16](=[O:17])[O:18][CH3:19])[n:15]1)[S:31](=[O:32])(=[O:33])[CH3:34]Participants
7
Sources & evidence
- ORD record
- ord-78e142d42d06412da1aa57b8dea714e3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…