Acetate → HCID 58930583, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:14][C:15]([c:16]2[cH:17][cH:18][c:19]([CH2:22][NH:23][c:24]3[s:25][c:26]4[c:27]([n:28]3)[cH:29][cH:30][c:31]([N+:33]([O-:34])=[O:35])[cH:32]4)[cH:20][cH:21]2)=[O:36])[cH:10][cH:11][cH:12][cH:13]1)=[O:37].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:44][C:45](=[O:46])[O-:47].[CH3:53][OH:54].[NH4+:43].[OH2:38].[OH2:39].[OH2:55].[Sn:40]([Cl:41])[Cl:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:14][C:15]([c:16]2[cH:17][cH:18][c:19]([CH2:22][NH:23][c:24]3[s:25][c:26]4[c:27]([n:28]3)[cH:29][cH:30][c:31]([NH2:33])[cH:32]4)[cH:20][cH:21]2)=[O:36])[cH:10][cH:11][cH:12][cH:13]1)=[O:37]Participants
8
Sources & evidence
- ORD record
- ord-95a4bd686cab441c8b2ca6da50bcb68a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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