Sodium ion → HCID 178494085, compound

HRID 2313017Notes

Reaction equation

HRID 2313017 reaction equation
[CH:59]([OH:60])([CH3:61])[CH3:62].[F:1][c:2]1[c:3]([S:9](=[O:10])(=[O:11])[NH:12][c:13]2[cH:14][c:15](-[c:21]3[cH:22][c:23]([NH:40][C:41](=[O:42])[c:43]4[n:44][c:45]([CH2:48][N:49]5[CH2:50][CH:51]([CH3:56])[O:52][CH:53]([CH3:55])[CH2:54]5)[s:46][cH:47]4)[c:24]4[cH:25][n:26][n:27]([S:30]([c:31]5[cH:32][cH:33][c:34]([CH3:35])[cH:36][cH:37]5)(=[O:38])=[O:39])[c:28]4[cH:29]3)[cH:16][n:17][c:18]2[O:19][CH3:20])[cH:4][cH:5][c:6]([F:8])[cH:7]1.[Na+:58].[OH-:57]>>[F:1][c:2]1[c:3]([S:9](=[O:10])(=[O:11])[NH:12][c:13]2[cH:14][c:15](-[c:21]3[cH:22][c:23]([NH:40][C:41](=[O:42])[c:43]4[n:44][c:45]([CH2:48][N:49]5[CH2:50][CH:51]([CH3:56])[O:52][CH:53]([CH3:55])[CH2:54]5)[s:46][cH:47]4)[c:24]4[cH:25][n:26][nH:27][c:28]4[cH:29]3)[cH:16][n:17][c:18]2[O:19][CH3:20])[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 3776IsopropanolHCID 178494087HCID 178494087, compound

Product 1

HCID 178494085HCID 178494085, compound

Sources & evidence

ORD record
ord-3e1e626bbc2741819f7ea9881e650688
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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