Acetate → HCID 58464845, compound

HRID 2144426Notes

Reaction equation

HRID 2144426 reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH3:40][C:41](=[O:42])[O-:43].[CH3:44][S:45]([CH3:46])=[O:47].[CH3:48][C:49]#[N:50].[K+:39].[N:18]1([c:24]2[cH:25][c:26]([B:30]([OH:31])[OH:32])[cH:27][cH:28][cH:29]2)[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]1.[NH2:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][c:12]2[cH:13][n:14][n:15]([CH3:17])[cH:16]2)[n:4][c:5]([Br:8])[cH:6][cH:7]1.[Na+:37].[Na+:38]>>[NH2:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][c:12]2[cH:13][n:14][n:15]([CH3:17])[cH:16]2)[n:4][c:5](-[c:26]2[cH:25][c:24]([N:18]3[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]3)[cH:29][cH:28][cH:27]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 175AcetateHCID 679Dimethyl SulfoxideHCID 813Potassium CationHCID 923Sodium ion2×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 17982644[3-(Piperidin-1-yl)phenyl]boronic acidHCID 58464823HCID 58464823, compound

Product 1

HCID 58464845HCID 58464845, compound

Sources & evidence

ORD record
ord-a7c5714ab59442cf91e1aa17a4c2b629
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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