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Acetate → 7-(4-Fluoro-phenoxy)-4-hydroxy-isoquinoline-3-carboxylic acid butyl ester

HRID 1226419
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인쇄 미리보기

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HRID 1226419 반응식
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10]([Br:27])[c:11]2[cH:12][c:13]([O:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:14][cH:15][c:16]2[c:17]1[OH:18].[CH3:29][C:30](=[O:31])[O-:32].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[CH3:39][OH:40].[Na+:28]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][cH:10][c:11]2[cH:12][c:13]([O:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:14][cH:15][c:16]2[c:17]1[OH:18]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 175AcetateHCID 887MethanolHCID 923Sodium IonHCID 8857Ethyl AcetateHCID 865954681-Bromo-7-(4-fluoro-phenoxy)-4-hydroxy-isoquinoline-3-carboxylic acid butyl ester

생성물 1

HCID 667129667-(4-Fluoro-phenoxy)-4-hydroxy-isoquinoline-3-carboxylic acid butyl ester

출처 및 근거

ORD 기록
ord-de3acb72d35948f18ca68d73d6cc2026
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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