Acetic Acid → HCID 178470955, compound
Reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[C:52](=[O:53])([OH:54])[O-:55].[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][CH2:7][CH:8]=[O:9])=[CH:10][c:11]1[cH:12][c:13]([O:23][CH3:24])[c:14](-[n:17]2[cH:18][n:19][c:20]([CH3:22])[cH:21]2)[cH:15][cH:16]1)=[O:25].[CH2:67]([Cl:68])[Cl:69].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:63][C:64](=[O:65])[OH:66].[NH2:26][CH:27]1[CH:28]([OH:36])[CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]21.[Na+:50].[Na+:56].[OH2:51]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][CH2:7][CH2:8][NH:26][CH:27]1[CH:28]([OH:36])[CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]21)=[CH:10][c:11]1[cH:12][c:13]([O:23][CH3:24])[c:14](-[n:17]2[cH:18][n:19][c:20]([CH3:22])[cH:21]2)[cH:15][cH:16]1)=[O:25]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-74eab713d9ed48a683be722ffc5101e4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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