Bicarbonate Ion → HCID 178503108, compound

HRID 1217211Notes

Reaction equation

HRID 1217211 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]([F:10])[F:11])[NH:12][CH:13]([CH2:14][CH:15]([CH3:16])[CH3:17])[C:18](=[O:19])[NH:20][C:21]2([C:24]#[N:25])[CH2:22][CH2:23]2)[cH:6][cH:7]1.[C:37](=[O:38])([O-:39])[O-:40].[C:43](=[O:44])([OH:45])[O-:46].[CH3:26][S:27][c:28]1[cH:29][cH:30][c:31]([B:34]([OH:35])[OH:36])[cH:32][cH:33]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Na+:41].[Na+:42].[Na+:47].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58]>>[c:2]1(-[c:31]2[cH:30][cH:29][c:28]([S:27][CH3:26])[cH:33][cH:32]2)[cH:3][cH:4][c:5]([CH:8]([CH:9]([F:10])[F:11])[NH:12][CH:13]([CH2:14][CH:15]([CH3:16])[CH3:17])[C:18](=[O:19])[NH:20][C:21]2([C:24]#[N:25])[CH2:22][CH2:23]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 27339594-(Methylthio)phenylboronic acidHCID 178446305HCID 178446305, compound

Product 1

HCID 178503108HCID 178503108, compound

Sources & evidence

ORD record
ord-814ed03b1562429da5667f124d937f86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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