Sodium ion → HCID 76834819, compound
Reaction equation
[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:27])([CH2:28][CH:29]([CH2:30][OH:31])[OH:32])[C:11](=[O:26])[N:12]([CH:21]3[CH:22]=[CH:23][CH2:24][CH2:25]3)[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1.[I+3:33]([O-:34])([O-:35])([O-:36])[O-:37].[Na+:38].[OH2:44]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:27])([CH2:28][CH:29]=[O:32])[C:11](=[O:26])[N:12]([CH:21]3[CH:22]=[CH:23][CH2:24][CH2:25]3)[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-774304ea2a59485aac001ea546b5efcb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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