Acetic Acid → Ethyl 6-(4-fluorobenzyl)-4-hydroxy-5-oxo-5,6,7,8-tetrahydro-2,6-naphthyridine-1-carboxylate 2-oxide

반응식

[CH3:26][CH2:27][OH:28].[CH3:29][C:30](=[O:31])[OH:32].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:23])[c:9]3[c:10]([OH:22])[cH:11][n:12][c:13]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[c:14]3[CH2:15][CH2:16]2)[cH:24][cH:25]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:23])[c:9]3[c:10]([OH:22])[cH:11][n+:12]([O-:28])[c:13]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[c:14]3[CH2:15][CH2:16]2)[cH:24][cH:25]1

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 702Ethanol

HCID 69061030Ethyl 6-(4-fluorobenzyl)-4-hydroxy-5-oxo-5,6,7,8-tetrahydro-2,6-naphthyridine-1-carboxylate

생성물 1

HCID 69064622Ethyl 6-(4-fluorobenzyl)-4-hydroxy-5-oxo-5,6,7,8-tetrahydro-2,6-naphthyridine-1-carboxylate 2-oxide

출처 및 근거

ORD 기록: ord-6aa70c98de064c858fe950197ade7708
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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