Bicarbonate Ion → HCID 46866374, compound

HRID 2314822Notes

Reaction equation

HRID 2314822 reaction equation
[C:38](=[O:39])([OH:40])[O-:41].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([NH:21][C:22]([CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[S:30])[n:10][cH:11][c:12](-[c:14]2[cH:15][cH:16][c:17]([OH:20])[cH:18][cH:19]2)[n:13]1.[CH3:31][C:32](=[O:33])[O:34][C:35](=[O:36])[CH3:37].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Na+:42].[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([NH:21][C:22]([CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[S:30])[n:10][cH:11][c:12](-[c:14]2[cH:15][cH:16][c:17]([O:20][C:32]([CH3:31])=[O:33])[cH:18][cH:19]2)[n:13]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1049PyridineHCID 7918Acetic AnhydrideHCID 8857Ethyl AcetateHCID 135934896HCID 135934896, compound

Product 1

HCID 46866374HCID 46866374, compound

Sources & evidence

ORD record
ord-eb5ac5af3e8b436eba2ef74e71c21cd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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