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Ethanol → 1-[4-{-2-(1,1-dimethylethylamino)-ethoxy}-phenyl]-3-[1H-indol-4-yl]-2-propen-1-one

HRID 97419
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HRID 97419 반응식
[CH3:14][C:15]([CH3:16])([CH3:17])[NH:18][CH2:19][CH2:20][O:21][c:22]1[cH:23][cH:24][c:25]([C:28]([CH3:29])=[O:30])[cH:26][cH:27]1.[CH3:31][CH2:32][OH:33].[Na+:13].[OH-:12].[OH2:34].[nH:1]1[cH:2][cH:3][c:4]2[c:5]([CH:10]=[O:11])[cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][cH:3][c:4]2[c:5]([CH:10]=[CH:29][C:28]([c:25]3[cH:24][cH:23][c:22]([O:21][CH2:20][CH2:19][NH:18][C:15]([CH3:14])([CH3:16])[CH3:17])[cH:27][cH:26]3)=[O:30])[cH:6][cH:7][cH:8][c:9]12
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반응물 6

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 333703Indole-4-carboxaldehydeHCID 136911921-[4-{-2-(1,1-Dimethylethylamino)-ethoxy}-phenyl]-ethanone

생성물 1

HCID 542383781-[4-{-2-(1,1-dimethylethylamino)-ethoxy}-phenyl]-3-[1H-indol-4-yl]-2-propen-1-one

출처 및 근거

ORD 기록
ord-db3721ffde844470b47143b5213900a5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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