Bicarbonate Ion → HCID 10870944, compound

HRID 685494Notes

Reaction equation

HRID 685494 reaction equation
[CH2:1]([CH:2]=[CH2:3])[N:4]1[C:5](=[O:26])[CH2:6][CH2:7][CH:8]1[c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][C:22]([F:23])([F:24])[F:25])[cH:19][cH:20]2)[cH:13][cH:14]1.[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[Na+:49].[O-:45][C:46]([OH:47])=[O:48].[OH2:27].[OH2:44].[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([OH:34])(=[O:35])=[O:36])[cH:37][cH:38]1>>[NH:4]1[C:5](=[O:26])[CH2:6][CH2:7][CH:8]1[c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][C:22]([F:23])([F:24])[F:25])[cH:19][cH:20]2)[cH:13][cH:14]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962Water2×HCID 6101p-Toluenesulfonic acidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 178456520HCID 178456520, compound

Product 1

HCID 10870944HCID 10870944, compound

Sources & evidence

ORD record
ord-69fcaff4dbeb43928a87b7205065c572
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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