Bicarbonate Ion → HCID 178459614, compound

HRID 289659Notes

Reaction equation

HRID 289659 reaction equation
[Br:1][c:2]1[c:3]([O:35][CH2:36][C:37](=[O:38])[OH:39])[c:4](-[c:30]2[n:31][n:32][n:33][nH:34]2)[s:5][c:6]1-[c:7]1[cH:8][c:9]([NH:13][CH:14]2[CH2:15][CH2:16][N:17]([S:20](=[O:21])(=[O:22])[CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:18][CH2:19]2)[cH:10][cH:11][cH:12]1.[C:49](=[O:50])([OH:51])[O-:52].[CH:40]([CH3:41])([CH3:42])[OH:43].[Na+:53].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[S:44](=[O:45])(=[O:46])([OH:47])[OH:48]>>[Br:1][c:2]1[c:3]([O:35][CH2:36][C:37]([O:38][CH:40]([CH3:41])[CH3:42])=[O:39])[c:4](-[c:30]2[n:31][n:32][n:33][nH:34]2)[s:5][c:6]1-[c:7]1[cH:8][c:9]([NH:13][CH:14]2[CH2:15][CH2:16][N:17]([S:20](=[O:21])(=[O:22])[CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:18][CH2:19]2)[cH:10][cH:11][cH:12]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1118Sulfuric AcidHCID 3776IsopropanolHCID 6228DimethylformamideHCID 178525941HCID 178525941, compound

Product 1

HCID 178459614HCID 178459614, compound

Sources & evidence

ORD record
ord-a115fced079e4056a73adfb35e7b67f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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