Acetic Acid → HCID 16728075, compound
Reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6](=[O:7])(=[O:8])[O:11][c:12]2[c:13]([C:30](=[O:31])[NH:32][CH2:33][c:34]3[c:35]([S:41](=[O:42])(=[O:43])[N:44]([CH3:45])[CH3:46])[cH:36][c:37]([F:40])[cH:38][cH:39]3)[n:14][c:15]([N:22]3[S:23](=[O:28])(=[O:29])[CH2:24][CH2:25][CH2:26][CH2:27]3)[c:16]3[cH:17][cH:18][cH:19][n:20][c:21]23)[cH:9][cH:10]1.[CH3:47][O-:48].[CH3:50][C:51](=[O:52])[OH:53].[CH3:54][CH2:55][OH:56].[CH3:62][OH:63].[Na+:49].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61]>>[OH:11][c:12]1[c:13]([C:30](=[O:31])[NH:32][CH2:33][c:34]2[c:35]([S:41](=[O:42])(=[O:43])[N:44]([CH3:45])[CH3:46])[cH:36][c:37]([F:40])[cH:38][cH:39]2)[n:14][c:15]([N:22]2[S:23](=[O:28])(=[O:29])[CH2:24][CH2:25][CH2:26][CH2:27]2)[c:16]2[cH:17][cH:18][cH:19][n:20][c:21]12Participants
8
Sources & evidence
- ORD record
- ord-b787f6959ec84a4fb08ffb51462d687d
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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