Bicarbonate Ion → HCID 178470967, compound

HRID 102917Notes

Reaction equation

HRID 102917 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]([c:9]1[cH:10][cH:11][c:12]([CH:15]=[CH:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:13][n:14]1)[CH:22]1[CH2:23][N:24]([CH2:27][c:28]2[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]2)[CH2:25][CH2:26]1)([CH3:5])([CH3:6])[CH3:7].[CH3:36][O:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH3:59][CH2:60][O:61][C:62]([CH3:63])=[O:64].[Cl:56][CH2:57][Cl:58].[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50].[Na+:55].[O-:51][C:52]([OH:53])=[O:54].[OH2:65]>>[NH:8]([c:9]1[cH:10][cH:11][c:12]([CH:15]=[CH:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:13][n:14]1)[CH:22]1[CH2:23][N:24]([CH2:27][c:28]2[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]2)[CH2:25][CH2:26]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 7519AnisoleHCID 8857Ethyl AcetateHCID 178470989HCID 178470989, compound

Product 1

HCID 178470967HCID 178470967, compound

Sources & evidence

ORD record
ord-00818cbbdd134484bb70dbab0c191c3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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