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Methanol → 6-(4-{[(3,5-Dicyclopentyl-4-isoxazolyl)methyl]oxy}phenyl)-2-quinolinecarboxylic acid

HRID 200380
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반응식

HRID 200380 반응식
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:38][OH:39].[CH:1]1([c:6]2[n:7][o:8][c:9]([CH:33]3[CH2:34][CH2:35][CH2:36][CH2:37]3)[c:10]2[CH2:11][O:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][c:21]4[cH:22][cH:23][c:24]([C:29](=[O:30])[O:31][CH3:32])[n:25][c:26]4[cH:27][cH:28]3)[cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Na+:41].[OH-:40]>>[CH:1]1([c:6]2[n:7][o:8][c:9]([CH:33]3[CH2:34][CH2:35][CH2:36][CH2:37]3)[c:10]2[CH2:11][O:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][c:21]4[cH:22][cH:23][c:24]([C:29](=[O:30])[OH:31])[n:25][c:26]4[cH:27][cH:28]3)[cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5]1
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반응물 5

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 59321530Methyl 6-(4-{[(3,5-dicyclopentyl-4-isoxazolyl)methyl]oxy}phenyl)-2-quinolinecarboxylate

생성물 1

HCID 593215186-(4-{[(3,5-Dicyclopentyl-4-isoxazolyl)methyl]oxy}phenyl)-2-quinolinecarboxylic acid

출처 및 근거

ORD 기록
ord-244b9602d9944ae59cbe6fa6756db93a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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