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Sodium Ion → 3-{3-[4-(2-Methyl-quinolin-4-ylmethoxy)-phenyl]-4,5-dihydro-isoxazol-5-yl}-acrylic acid tert-butyl ester

HRID 1225768
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인쇄 미리보기

반응식

HRID 1225768 반응식
[CH3:17][c:18]1[n:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[c:26]([CH2:28][O:29][c:30]2[cH:31][cH:32][c:33]([C:36]3=[N:37][O:38][CH:39]([CH:41]=[O:42])[CH2:40]3)[cH:34][cH:35]2)[cH:27]1.[CH3:1][O:2][P:3]([O:4][CH3:5])(=[O:6])[CH2:7][C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14].[H-:15].[Na+:16].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[CH:7]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])=[CH:41][CH:39]1[O:38][N:37]=[C:36]([c:33]2[cH:32][cH:31][c:30]([O:29][CH2:28][c:26]3[c:25]4[c:20]([n:19][c:18]([CH3:17])[cH:27]3)[cH:21][cH:22][cH:23][cH:24]4)[cH:35][cH:34]2)[CH2:40]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium IonHCID 6228DimethylformamideHCID 166653HydrideHCID 4564495tert-Butyl DimethylphosphonoacetateHCID 218980783-[4-(2-Methyl-quinolin-4-ylmethoxy)-phenyl]-4,5-dihydro-isoxazole-5-carbaldehyde

생성물 1

HCID 696396783-{3-[4-(2-Methyl-quinolin-4-ylmethoxy)-phenyl]-4,5-dihydro-isoxazol-5-yl}-acrylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-74805b2bbdab49929ac09a0d3a70c3ca
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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