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Methanol → 6-{[(1H-imidazol-2-ylmethyl)-amino]-methyl}-5,6,7,8-tetrahydro-imidazo[1,2-a]pyridine-2-carboxylic acid-(4-dipropylamino-butyl)-amide

HRID 1567979
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인쇄 미리보기

반응식

HRID 1567979 반응식
[BH4-:40].[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][NH:9][C:10](=[O:11])[c:12]1[n:13][c:14]2[n:15]([cH:22]1)[CH2:16][CH:17]([CH2:20][NH2:21])[CH2:18][CH2:19]2)[CH2:23][CH2:24][CH3:25].[CH3:42][OH:43].[CH:26]([O:27][CH3:28])([O:29][CH3:30])[O:31][CH3:32].[Na+:41].[OH2:44].[nH:33]1[c:34]([CH:38]=[O:39])[n:35][cH:36][cH:37]1>>[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][NH:9][C:10](=[O:11])[c:12]1[n:13][c:14]2[n:15]([cH:22]1)[CH2:16][CH:17]([CH2:20][NH:21][CH2:38][c:34]1[nH:33][cH:37][cH:36][n:35]1)[CH2:18][CH2:19]2)[CH2:23][CH2:24][CH3:25]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 887MethanolHCID 923Sodium IonHCID 962WaterHCID 9005Trimethyl orthoformateHCID 249551H-imidazole-2-carbaldehydeHCID 28123BorohydrideHCID 231556046-Aminomethyl-5,6,7,8-tetrahydro-imidazo[1,2-a]pyridine-2-carboxylic acid-(4-dipropylamino-butyl)-amide

생성물 1

HCID 231554046-{[(1H-imidazol-2-ylmethyl)-amino]-methyl}-5,6,7,8-tetrahydro-imidazo[1,2-a]pyridine-2-carboxylic acid-(4-dipropylamino-butyl)-amide

출처 및 근거

ORD 기록
ord-54b5092b6b0f431cba8e3dc5c11650f3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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