Bicarbonate Ion → HCID 57917659, compound

HRID 1209452Notes

Reaction equation

HRID 1209452 reaction equation
[C:49](=[O:50])([O-:51])[OH:52].[C:54]([O:55][CH2:56][CH3:57])(=[O:58])[CH3:59].[CH2:39]([P:40]([OH:41])(=[O:42])[OH:43])[CH2:44][CH3:45].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH:1]1([NH:5][C:6]([c:7]2[cH:8][c:9]([CH2:13][N:14]3[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]3)[cH:10][cH:11][cH:12]2)=[O:20])[CH2:2][CH2:3][CH2:4]1.[Cl:46][CH2:47][Cl:48].[NH2:21][c:22]1[c:23]([F:31])[cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30]1.[Na+:53]>>[CH:1]1([NH:5][C:6]([c:7]2[cH:8][c:9]([CH2:13][N:14]3[CH2:15][CH2:16][N:17]([C:26]([c:25]4[cH:24][c:23]([F:31])[c:22]([NH2:21])[cH:30][cH:29]4)=[O:27])[CH2:18][CH2:19]3)[cH:10][cH:11][cH:12]2)=[O:20])[CH2:2][CH2:3][CH2:4]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 99714-Amino-3-fluorobenzoic acidHCID 204484Propylphosphonic acidHCID 57917592HCID 57917592, compound

Product 1

HCID 57917659HCID 57917659, compound

Sources & evidence

ORD record
ord-4274c0513688411789df7d6494cebaad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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