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Potassium Cation → methyl 3-[1-[4-[5-methyl-2-(2-thienyl)-4-oxazolylmethoxy]benzyl]-3-phenyl-1H-pyrazol-4-yl]propionate

HRID 1130592
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HRID 1130592 반응식
[C:39](=[O:40])([O-:41])[O-:42].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Cl:1][CH2:2][c:3]1[n:4][c:5](-[c:9]2[s:10][cH:11][cH:12][cH:13]2)[o:6][c:7]1[CH3:8].[K+:43].[K+:44].[OH2:50].[OH:14][c:15]1[cH:16][cH:17][c:18]([CH2:19][n:20]2[n:21][c:22](-[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[c:23]([CH2:25][CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:24]2)[cH:37][cH:38]1>>[CH2:2]([c:3]1[n:4][c:5](-[c:9]2[s:10][cH:11][cH:12][cH:13]2)[o:6][c:7]1[CH3:8])[O:14][c:15]1[cH:16][cH:17][c:18]([CH2:19][n:20]2[n:21][c:22](-[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[c:23]([CH2:25][CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:24]2)[cH:37][cH:38]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 50764914-(Chloromethyl)-5-methyl-2-(thiophen-2-yl)-1,3-oxazoleHCID 23024960methyl 3-[1-(4-hydroxybenzyl)-3-phenyl-1H-pyrazol-4-yl]propionate

생성물 1

HCID 69423000
methyl 3-[1-[4-[5-methyl-2-(2-thienyl)-4-oxazolylmethoxy]benzyl]-3-phenyl-1H-pyrazol-4-yl]propionate

출처 및 근거

ORD 기록
ord-aba891778ecb42188c0ad65f42a43ace
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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