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Methanol → 3-(5-{5-[4-phenyl-5-(trifluoromethyl)-2-thienyl]-1,2,4-oxadiazol-3-yl}-1H-indol-1-yl)propanoic acid

HRID 1123670
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반응식

HRID 1123670 반응식
[CH3:39][OH:40].[Na+:38].[OH-:37].[c:1]1(-[c:7]2[cH:8][c:9](-[c:16]3[n:17][c:18](-[c:21]4[cH:22][c:23]5[cH:24][cH:25][n:26]([CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[c:27]5[cH:28][cH:29]4)[n:19][o:20]3)[s:10][c:11]2[C:12]([F:13])([F:14])[F:15])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[cH:8][c:9](-[c:16]3[n:17][c:18](-[c:21]4[cH:22][c:23]5[cH:24][cH:25][n:26]([CH2:30][CH2:31][C:32](=[O:33])[OH:34])[c:27]5[cH:28][cH:29]4)[n:19][o:20]3)[s:10][c:11]2[C:12]([F:13])([F:14])[F:15])[cH:2][cH:3][cH:4][cH:5][cH:6]1
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반응물 4

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 59318376Ethyl 3-(5-{5-[4-phenyl-5-(trifluoromethyl)-2-thienyl]-1,2,4-oxadiazol-3-yl}-1H-indol-1-yl)propanoate

생성물 1

HCID 248247243-(5-{5-[4-phenyl-5-(trifluoromethyl)-2-thienyl]-1,2,4-oxadiazol-3-yl}-1H-indol-1-yl)propanoic acid

출처 및 근거

ORD 기록
ord-937e5a96d8d14481bf9dee18aa4ed77f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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