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Hydrochloric Acid → 3-[5-(5-{3-Chloro-4-[(difluoromethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-1-isoquinolinyl]propanoic acid

HRID 1563679
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인쇄 미리보기

반응식

HRID 1563679 반응식
[CH2:37]1[O:38][CH2:39][CH2:40][O:41][CH2:42]1.[CH3:43][OH:44].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[c:18]4[cH:19][cH:20][n:21][c:22]([CH2:27][CH2:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[c:23]4[cH:24][cH:25][cH:26]3)[n:15][o:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([F:10])[F:11].[ClH:36]>>[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[c:18]4[cH:19][cH:20][n:21][c:22]([CH2:27][CH2:28][C:29](=[O:30])[OH:31])[c:23]4[cH:24][cH:25][cH:26]3)[n:15][o:16]2)[cH:5][cH:6][c:7]1[O:8][CH:9]([F:10])[F:11]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 581499271,1-Dimethylethyl 3-[5-(5-{3-chloro-4-[(difluoromethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-1-isoquinolinyl]propanoate

생성물 1

HCID 444766713-[5-(5-{3-Chloro-4-[(difluoromethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-1-isoquinolinyl]propanoic acid

출처 및 근거

ORD 기록
ord-5bb4431065e94e9d952420dd7defdec4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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