Acetate → HCID 77240806, compound

HRID 1536141Notes

Reaction equation

HRID 1536141 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH:5]([CH3:25])[CH2:6][CH:7]([NH2:24])[c:8]2[cH:9][c:10](-[c:14]3[cH:15][c:16]([C:17](=[O:18])[O:19][CH3:20])[cH:21][cH:22][cH:23]3)[cH:11][cH:12][c:13]21.[C:43]([O-:44])(=[O:45])[CH3:46].[C:48]([O-:49])(=[O:50])[CH3:51].[Cl:35][CH2:36][Cl:37].[Cu+2:47].[Na+:42].[O-:38][C:39]([OH:40])=[O:41].[n:26]1[cH:27][c:28]([B:32]([OH:33])[OH:34])[cH:29][cH:30][cH:31]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH:5]([CH3:25])[CH2:6][CH:7]([NH:24][c:28]2[cH:27][n:26][cH:31][cH:30][cH:29]2)[c:8]2[cH:9][c:10](-[c:14]3[cH:15][c:16]([C:17](=[O:18])[O:19][CH3:20])[cH:21][cH:22][cH:23]3)[cH:11][cH:12][c:13]21

Participants

8

Reactant 7

HCID 175Acetate2×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 27099Cupric cationHCID 27343783-Pyridinylboronic acidHCID 77240607methyl 3-(1-acetyl-4-amino-2-methyl-3,4-dihydro-2H-quinolin-6-yl)benzoate

Product 1

HCID 77240806HCID 77240806, compound

Sources & evidence

ORD record
ord-9d6fe834002a47648c2b3be52e63bb54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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