Acetic Acid → HCID 53991723, compound
Reaction equation
[C:22](=[O:23])([O-:24])[OH:25].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([SH:21])[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][c:16]1[S:17]([NH2:18])(=[O:19])=[O:20].[CH3:43][C:44](=[O:45])[OH:46].[CH:35](=[CH2:36])[c:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1.[Na+:26].[Na+:33].[Na+:34].[S:27]([S:28]([O-:29])=[O:30])([O-:31])=[O:32]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([S:21][CH2:36][CH2:35][c:37]2[cH:38][cH:39][n:40][cH:41][cH:42]2)[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][c:16]1[S:17]([NH2:18])(=[O:19])=[O:20]Participants
7
Sources & evidence
- ORD record
- ord-a76e9221d5b749658edba39e7eec5420
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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