Glyoxylic Acid → 2-(3,4-Dimethoxyphenyl)-2-(1,3-dioxoisoindolin-5-ylamino)acetic acid

HRID 1137090Notes

Reaction equation

HRID 1137090 reaction equation
[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][c:6]([NH:11][CH:12]([C:13](=[O:14])[OH:15])[c:16]2[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]2)[cH:7][cH:8][c:9]1[F:10].[C:52]([OH:53])(=[O:54])[CH:55]=[O:56].[CH3:38][O:39][c:40]1[cH:41][c:42]([B:43]([OH:44])[OH:45])[cH:46][cH:47][c:48]1[O:49][CH3:50].[NH:26]=[C:27]1[CH:28]=[CH:29][C:30]2=[C:35]([C:33](=[O:34])[NH:31][C:32]2=[O:36])[CH2:37]1.[OH2:51]>>[C:1]1(=[O:3])[NH:2][C:32](=[O:36])[c:9]2[c:4]1[cH:5][c:6]([NH:11][CH:12]([C:13](=[O:14])[OH:15])[c:16]1[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]1)[cH:7][cH:8]2

Participants

6

Reactant 5

HCID 760Glyoxylic AcidHCID 962WaterHCID 27347023,4-Dimethoxyphenylboronic acidHCID 594793922-(3-Carbamoyl-4-fluorophenylamino)-2-(3,4-dimethoxyphenyl)acetic acidHCID 68106733HCID 68106733, compound

Product 1

HCID 594794702-(3,4-Dimethoxyphenyl)-2-(1,3-dioxoisoindolin-5-ylamino)acetic acid

Sources & evidence

ORD record
ord-a61f259e8c2c4154805bd9927226f5cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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