Acetic Acid → HCID 178505045, compound
Reaction equation
[C:44]([O:45][BH-:46]([O:47][C:48](=[O:49])[CH3:50])[O:51][C:52](=[O:53])[CH3:54])(=[O:55])[CH3:56].[CH3:1][C:2](=[O:3])[OH:4].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[NH2:5][CH2:6][CH:7]([OH:8])[c:9]1[cH:10][cH:11][c:12]([OH:20])[c:13]([NH:15][S:16](=[O:17])(=[O:18])[CH3:19])[cH:14]1.[Na+:57].[O:21]=[C:22]1[CH2:23][CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([S:34](=[O:35])(=[O:36])[N:37]3[C:38](=[O:43])[NH:39][C:40](=[O:42])[CH2:41]3)[cH:32][cH:33]2)[CH2:26][CH2:27]1>>[NH:5]([CH2:6][CH:7]([OH:8])[c:9]1[cH:10][cH:11][c:12]([OH:20])[c:13]([NH:15][S:16](=[O:17])(=[O:18])[CH3:19])[cH:14]1)[CH:22]1[CH2:23][CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([S:34](=[O:35])(=[O:36])[N:37]3[C:38](=[O:43])[NH:39][C:40](=[O:42])[CH2:41]3)[cH:32][cH:33]2)[CH2:26][CH2:27]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-bb4ab4bb8a3041d7842dbc0780e64b65
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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