6-fluoro-4H-1,3-benzodioxine-8-carboxylic acid → HCID 178508551, 화합물

HRID 1234277

반응식

HRID 1234277 반응식
[F:24][c:25]1[cH:26][c:27]([C:35](=[O:36])[OH:37])[c:28]2[c:29]([cH:34]1)[CH2:30][O:31][CH2:32][O:33]2.[NH2:1][c:2]1[s:3][c:4](-[c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[c:5]([C:7](=[O:8])[N:9]2[CH:10]3[CH2:11][CH:12]3[CH2:13][CH:14]2[CH2:15][NH2:16])[n:6]1>>[NH2:1][c:2]1[s:3][c:4](-[c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[c:5]([C:7](=[O:8])[N:9]2[CH:10]3[CH2:11][CH:12]3[CH2:13][CH:14]2[CH2:15][NH:16][C:35]([c:27]2[cH:26][c:25]([F:24])[cH:34][c:29]3[c:28]2[O:33][CH2:32][O:31][CH2:30]3)=[O:36])[n:6]1

참가 물질

3

반응물 2

HCID 27799016-fluoro-4H-1,3-benzodioxine-8-carboxylic acidHCID 178509363HCID 178509363, 화합물

생성물 1

HCID 178508551HCID 178508551, 화합물

출처 및 근거

ORD 기록
ord-8a7b66e93c404ed4a04a5bed8f4b085e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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