Bicarbonate Ion → HCID 57843282, compound

HRID 2130800Notes

Reaction equation

HRID 2130800 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[n:6][cH:7][c:8]([N:12]3[C:13](=[O:25])[CH2:14][N:15]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:16][CH2:17]3)[n:9][c:10]2[cH:11]1.[C:51](=[O:52])([OH:53])[O-:54].[CH2:56]1[O:57][CH2:58][CH2:59][O:60][CH2:61]1.[CH3:26][C:27]1([CH3:28])[C:29]([CH3:30])([CH3:31])[O:32][B:33]([c:34]2[cH:35][c:36]([NH:40][S:41](=[O:42])(=[O:43])[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[cH:37][n:38][cH:39]2)[O:50]1.[Na+:55]>>[c:2]1(-[c:34]2[cH:35][c:36]([NH:40][S:41](=[O:42])(=[O:43])[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[cH:37][n:38][cH:39]2)[cH:3][cH:4][c:5]2[n:6][cH:7][c:8]([N:12]3[C:13](=[O:25])[CH2:14][N:15]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:16][CH2:17]3)[n:9][c:10]2[cH:11]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 312751,4-DioxaneHCID 52936632N-[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]benzenesulfonamideHCID 68505932HCID 68505932, compound

Product 1

HCID 57843282HCID 57843282, compound

Sources & evidence

ORD record
ord-f647ab1a07934435a894ee762fdaad2b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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