Sodium ion → HCID 178450547, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:50]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([S:38][CH2:39][c:40]4[nH:41][cH:42][c:43]([CH2:45][C:46]([F:47])([F:48])[F:49])[n:44]4)[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1.[Cl:69][CH2:70][Cl:71].[Na+:67].[Na+:68].[OH:51][O:52][C:53]([c:54]1[cH:55][c:56]([Cl:57])[cH:58][cH:59][cH:60]1)=[O:61].[S:62]([O-:63])([O-:64])(=[O:65])=[S:66]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:50]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([S:38]([CH2:39][c:40]4[nH:41][cH:42][c:43]([CH2:45][C:46]([F:47])([F:48])[F:49])[n:44]4)=[O:51])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1Participants
6
Sources & evidence
- ORD record
- ord-4326653ac3544ff9af9280a1d28fb287
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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