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Acetone → 2-(4-Azidobutyl)-1,4-dihydro-5-methoxycarbonyl-6-methyl-4-(4-nitrophenyl)pyridine-3-carboxylic acid

HRID 1236577
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인쇄 미리보기

반응식

HRID 1236577 반응식
[CH3:37][C:38](=[O:39])[CH3:40].[K+:36].[N:1](=[N+:2]=[N-:3])[CH2:4][CH2:5][CH2:6][CH2:7][C:8]1=[C:13]([C:14](=[O:15])[O:16][CH2:17][CH2:18][C:19]#[N:20])[CH:12]([c:21]2[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]2)[C:11]([C:30](=[O:31])[O:32][CH3:33])=[C:10]([CH3:34])[NH:9]1.[OH-:35]>>[N:1](=[N+:2]=[N-:3])[CH2:4][CH2:5][CH2:6][CH2:7][C:8]1=[C:13]([C:14](=[O:15])[OH:16])[CH:12]([c:21]2[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]2)[C:11]([C:30](=[O:31])[O:32][CH3:33])=[C:10]([CH3:34])[NH:9]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 180AcetoneHCID 813Potassium CationHCID 961HydroxideHCID 865866352-(4-Azidobutyl)-3-(2-cyanoethoxy) carbonyl-1,4-dihydro-5-methoxycarbonyl-6-methyl-4-(4-nitrophenyl)pyridine

생성물 1

HCID 183607782-(4-Azidobutyl)-1,4-dihydro-5-methoxycarbonyl-6-methyl-4-(4-nitrophenyl)pyridine-3-carboxylic acid

출처 및 근거

ORD 기록
ord-cc297acd90a64748b6ec8f967eb9769d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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