Ethanol → HCID 59275558, compound

HRID 283346Notes

Reaction equation

HRID 283346 reaction equation
[CH3:53][CH2:54][OH:55].[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[F:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([c:14]2[C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:20][c:21](-[c:30]2[cH:31][c:32]([C:36]([NH:37][C:38]([CH3:39])([CH3:40])[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)=[O:47])[cH:33][cH:34][cH:35]2)[c:22]([N:24]([S:25](=[O:26])(=[O:27])[CH3:28])[CH3:29])[cH:23]3)[cH:8][cH:9]1.[Na+:2].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH-:1]>>[F:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([c:14]2[C:15](=[O:16])[OH:17])[cH:20][c:21](-[c:30]2[cH:31][c:32]([C:36]([NH:37][C:38]([CH3:39])([CH3:40])[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)=[O:47])[cH:33][cH:34][cH:35]2)[c:22]([N:24]([S:25](=[O:26])(=[O:27])[CH3:28])[CH3:29])[cH:23]3)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 59275384HCID 59275384, compound

Product 1

HCID 59275558HCID 59275558, compound

Sources & evidence

ORD record
ord-3c8e38df541540f5801c13b49632b77d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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