Bicarbonate Ion → HCID 178489896, compound

HRID 282355Notes

Reaction equation

HRID 282355 reaction equation
[Br:47][CH2:48][CH2:49][OH:50].[C:52](=[O:53])([OH:54])[O-:55].[CH3:57][N:58]([c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1)[CH3:65].[CH3:71][CH2:72][O:73][C:74](=[O:75])[CH3:76].[CH:1]1([N:2]=[C:3]=[N:4][CH:5]2[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1.[F:16][c:17]1[cH:18][cH:19][c:20](-[c:23]2[c:24]([C:44](=[O:45])[OH:46])[n:25][c:26]([CH:28]=[CH:29][c:30]3[cH:31][c:32]([O:42][CH3:43])[c:33](-[n:36]4[cH:37][n:38][c:39]([CH3:41])[cH:40]4)[cH:34][cH:35]3)[nH:27]2)[cH:21][cH:22]1.[Na+:56].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[OH2:51]>>[F:16][c:17]1[cH:18][cH:19][c:20](-[c:23]2[c:24]([C:44](=[O:45])[O:46][CH2:49][CH2:48][Br:47])[n:25][c:26]([CH:28]=[CH:29][c:30]3[cH:31][c:32]([O:42][CH3:43])[c:33](-[n:36]4[cH:37][n:38][c:39]([CH3:41])[cH:40]4)[cH:34][cH:35]3)[nH:27]2)[cH:21][cH:22]1

Participants

10

Reactant 9

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 10868DicyclohexylcarbodiimideHCID 108982-BromoethanolHCID 142844-(Dimethylamino)pyridineHCID 178489894HCID 178489894, compound

Product 1

HCID 178489896HCID 178489896, compound

Sources & evidence

ORD record
ord-3cefeb8f0dc642b4b3ffa576a80ab385
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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