Sodium ion → HCID 67492851, compound
Reaction equation
[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[cH:10][c:11]([C:15]3([CH2:19][NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH2:16][O:17][CH2:18]3)[cH:12][cH:13][cH:14]2)[O:28]1.[CH3:75][CH2:76][O:77][C:78](=[O:79])[CH3:80].[I:29][c:30]1[c:31]2[c:32]([n:33][cH:34][cH:35]1)[n:36]([C:43]([c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)([c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)[c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1)[n:37][c:38]2[C:39]([F:40])([F:41])[F:42].[Na+:62].[Na+:63].[O-:64][C:65](=[O:66])[O-:67].[O:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1.[OH2:68]>>[c:9]1(-[c:30]2[c:31]3[c:32]([n:33][cH:34][cH:35]2)[n:36]([C:43]([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[n:37][c:38]3[C:39]([F:40])([F:41])[F:42])[cH:10][c:11]([C:15]2([CH2:19][NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH2:16][O:17][CH2:18]2)[cH:12][cH:13][cH:14]1Participants
8
Sources & evidence
- ORD record
- ord-0151a344c93943888f729708bf03de2c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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