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Benzaldehyde → (+/-)-6-[4-(1-Benzyl-piperidin-3-yl)-phenoxy]-nicotinamide

HRID 117860
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HRID 117860 반응식
[BH4-:46].[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[CH3:48][C:49]#[N:50].[CH3:51][OH:52].[CH:24](=[O:25])[c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[ClH:1].[NH:2]1[CH2:3][CH:4]([c:8]2[cH:9][cH:10][c:11]([O:12][c:13]3[n:14][cH:15][c:16]([C:17](=[O:18])[NH2:19])[cH:20][cH:21]3)[cH:22][cH:23]2)[CH2:5][CH2:6][CH2:7]1.[Na+:45].[Na+:47]>>[N:2]1([CH2:24][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:3][CH:4]([c:8]2[cH:9][cH:10][c:11]([O:12][c:13]3[n:14][cH:15][c:16]([C:17](=[O:18])[NH2:19])[cH:20][cH:21]3)[cH:22][cH:23]2)[CH2:5][CH2:6][CH2:7]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 240BenzaldehydeHCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium Ion2회HCID 6342AcetonitrileHCID 28123BorohydrideHCID 2724942Triacetoxyborohydride
HCID 59730349
6-(4-Piperidin-3-ylphenoxy)pyridine-3-carboxamide

생성물 1

HCID 59730236(+/-)-6-[4-(1-Benzyl-piperidin-3-yl)-phenoxy]-nicotinamide

출처 및 근거

ORD 기록
ord-8d16c770b5c543b19f71067868b5ab11
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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