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Methanol → Tert-butyl 4-(3-(hydroxymethyl)-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazin-4-yloxy)piperidine-1-carboxylate

HRID 1559584
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HRID 1559584 반응식
[BH4-:36].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([C:32](=[O:33])[O:34][CH3:35])[n:17][n:18](-[c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[c:19](=[O:21])[cH:20]2)[CH2:12][CH2:13]1.[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:38][CH2:39][O:40][C:41]([CH3:42])=[O:43].[CH3:50][OH:51].[Na+:37].[OH2:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([CH2:32][OH:33])[n:17][n:18](-[c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[c:19](=[O:21])[cH:20]2)[CH2:12][CH2:13]1
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참가 물질

8

반응물 7

HCID 887MethanolHCID 923Sodium IonHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28123BorohydrideHCID 44621631Methyl 4-(1-(tert-butoxycarbonyl)piperidin-4-yloxy)-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazine-3-carboxylate

생성물 1

HCID 67072635Tert-butyl 4-(3-(hydroxymethyl)-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazin-4-yloxy)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-c84cb2d675334282bee578d87f38d83a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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