Acetic Acid → HCID 13578906, compound
Reaction equation
[CH3:1][C:2]([OH:3])=[O:4].[F:12][c:13]1[c:14]([C:15](=[O:16])[NH:17][C:18](=[O:19])[NH:20][c:21]2[c:22]([F:35])[cH:23][c:24]([S:27](=[O:28])[C:29]([CH:30]([F:31])[F:32])([F:33])[F:34])[cH:25][cH:26]2)[c:36]([Cl:40])[cH:37][cH:38][cH:39]1.[OH2:43].[OH:41][OH:42].[OH:5][C:6]([C:7]([F:8])([F:9])[F:10])=[O:11]>>[O:3]=[S:27]([c:24]1[cH:23][c:22]([F:35])[c:21]([NH:20][C:18]([NH:17][C:15]([c:14]2[c:13]([F:12])[cH:39][cH:38][cH:37][c:36]2[Cl:40])=[O:16])=[O:19])[cH:26][cH:25]1)(=[O:28])[C:29]([CH:30]([F:31])[F:32])([F:33])[F:34]Participants
6
Sources & evidence
- ORD record
- ord-ca457b49d96f4165970c7cab6b5d8ddc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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