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Ethanol → Tert-butyl 3-[5-[3-[4-(4-methylpiperazin-1-yl)phenyl]-3-oxoprop-1-enyl]-2-pyridinyl]prop-2-enoate

HRID 2131676
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반응식

HRID 2131676 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]=[CH:8][c:9]1[n:10][cH:11][c:12]([CH:15]=[O:16])[cH:13][cH:14]1)=[O:17].[CH3:18][N:19]1[CH2:20][CH2:21][N:22]([c:25]2[cH:26][cH:27][c:28]([C:31]([CH3:32])=[O:33])[cH:29][cH:30]2)[CH2:23][CH2:24]1.[CH3:36][CH2:37][OH:38].[K+:35].[OH-:34]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]=[CH:8][c:9]1[n:10][cH:11][c:12]([CH:15]=[CH:32][C:31]([c:28]2[cH:27][cH:26][c:25]([N:22]3[CH2:21][CH2:20][N:19]([CH3:18])[CH2:24][CH2:23]3)[cH:30][cH:29]2)=[O:33])[cH:13][cH:14]1)=[O:17]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 335514-(4-Methyl-1-piperazinyl)acetophenoneHCID 750771563-(5-Formyl-pyridin-2-yl)-acrylic acid tert-butyl ester

생성물 1

HCID 67049804Tert-butyl 3-[5-[3-[4-(4-methylpiperazin-1-yl)phenyl]-3-oxoprop-1-enyl]-2-pyridinyl]prop-2-enoate
이 페이지에서참가 물질출처 및 근거반응 노트

출처 및 근거

ORD 기록
ord-6db8823d38f1428d9a0453afc7601df2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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