2-(3-formylphenoxy)-N,N-dimethylacetamide → 4-hydroxy-3-[3-[3-[(dimethylaminocarbonyl)methoxy]phenyl]-1-oxo-2-propenyl]-1,6-dimethyl-2(1H)-pyridinone

반응식

[C:16]([CH3:17])(=[O:18])[c:19]1[c:20](=[O:28])[n:21]([CH3:27])[c:22]([CH3:26])[cH:23][c:24]1[OH:25].[CH3:1][N:2]([C:3](=[O:4])[CH2:5][O:6][c:7]1[cH:8][c:9]([CH:10]=[O:11])[cH:12][cH:13][cH:14]1)[CH3:15]>>[CH3:1][N:2]([C:3](=[O:4])[CH2:5][O:6][c:7]1[cH:8][c:9]([CH:10]=[CH:17][C:16](=[O:18])[c:19]2[c:20](=[O:28])[n:21]([CH3:27])[c:22]([CH3:26])[cH:23][c:24]2[OH:25])[cH:12][cH:13][cH:14]1)[CH3:15]

참가 물질

반응물 2

HCID 144744582-(3-formylphenoxy)-N,N-dimethylacetamide

HCID 546917032(1H)-Pyridone, 3-acetyl-4-hydroxy-1,6-dimethyl-

생성물 1

HCID 1363442464-hydroxy-3-[3-[3-[(dimethylaminocarbonyl)methoxy]phenyl]-1-oxo-2-propenyl]-1,6-dimethyl-2(1H)-pyridinone

출처 및 근거

ORD 기록: ord-4b25bd48f6b748b0b9227d7251c5a245
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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