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

HRID 1545720
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반응식

HRID 1545720 반응식
[C:1]([CH3:2])(=[O:3])[C:4]1=[C:9]([CH3:10])[NH:8][C:7]([CH2:11][CH2:12][CH2:13][CH2:14][N:15]=[N+:16]=[N-:17])=[C:6]([C:18](=[O:19])[O:20][CH2:21][CH2:22][C:23]#[N:24])[CH:5]1[c:25]1[cH:26][cH:27][c:28]([N+:31](=[O:32])[O-:33])[cH:29][cH:30]1.[CH3:36][C:37](=[O:38])[CH3:39].[K+:35].[OH-:34]>>[C:1]([CH3:2])(=[O:3])[C:4]1=[C:9]([CH3:10])[NH:8][C:7]([CH2:11][CH2:12][CH2:13][CH2:14][N:15]=[N+:16]=[N-:17])=[C:6]([C:18](=[O:19])[OH:20])[CH:5]1[c:25]1[cH:26][cH:27][c:28]([N+:31](=[O:32])[O-:33])[cH:29][cH:30]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 180AcetoneHCID 813Potassium CationHCID 961HydroxideHCID 230040535-Acetyl-2-(4-azidobutyl)-3-(2-cyanoethoxy)carbonyl-1,4-dihydro-6-methyl-4-(4-nitrophenyl)pyridine

생성물 1

HCID 230041805-Acetyl-2-(4-azidobutyl)-1,4-dihydro-6-methyl-4-(4-nitrophenyl)pyridine-3-carboxylic acid

출처 및 근거

ORD 기록
ord-1c5dd1c1688f4e08a33b3259e3f7ea91
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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