Bicarbonate Ion → HCID 178451678, compound

HRID 281982Notes

Reaction equation

HRID 281982 reaction equation
[Br:6][c:7]1[cH:8][cH:9][c:10](-[c:13]2[n:14][o:15][c:16]([CH:18]3[N:19]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:20][CH2:21][CH2:22]3)[n:17]2)[cH:11][cH:12]1.[C:1](=[O:2])([OH:3])[O-:4].[CH3:30][C:31]1([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36][B:37]([c:38]2[cH:39][cH:40][c:41](-[c:44]3[cH:45][n:46][c:47]([CH:49]4[N:50]([C:54](=[O:55])[O:56][C:57]([CH3:58])([CH3:59])[CH3:60])[CH2:51][CH2:52][CH2:53]4)[nH:48]3)[cH:42][cH:43]2)[O:61]1.[CH3:62][O:63][CH2:64][CH2:65][O:66][CH3:67].[Na+:5]>>[c:7]1(-[c:38]2[cH:39][cH:40][c:41](-[c:44]3[cH:45][nH:46][c:47]([CH:49]4[N:50]([C:54](=[O:55])[O:56][C:57]([CH3:58])([CH3:59])[CH3:60])[CH2:51][CH2:52][CH2:53]4)[n:48]3)[cH:42][cH:43]2)[cH:8][cH:9][c:10](-[c:13]2[n:14][o:15][c:16]([CH:18]3[N:19]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:20][CH2:21][CH2:22]3)[n:17]2)[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 80711,2-DimethoxyethaneHCID 574497592-{4-[4-(4,4,5,5-Tetramethyl[1,3,2]dioxaborolan-2-yl)phenyl]-1h-imidazol-2-yl}pyrrolidine-1-carboxylic acid tert-butyl esterHCID 67224084HCID 67224084, compound

Product 1

HCID 178451678HCID 178451678, compound

Sources & evidence

ORD record
ord-5f85302e7deb46b7816e9c7779a6e894
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…