Hydrochloric Acid → Benzyl 4-(dimethylamino)-3-(9-pyridin-3-ylnonanoylamino)butanoate

반응식

[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[O:27][C:28]([CH2:29][CH:30]([CH2:31][N:32]([CH3:33])[CH3:34])[NH2:35])=[O:36].[ClH:18].[ClH:19].[n:1]1[cH:2][c:3]([CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:15](=[O:16])[OH:17])[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3]([CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:15](=[O:17])[NH:35][CH:30]([CH2:29][C:28]([O:27][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)=[O:36])[CH2:31][N:32]([CH3:33])[CH3:34])[cH:4][cH:5][cH:6]1

참가 물질

반응물 3

HCID 313Hydrochloric Acid2회

HCID 202234273-Pyridinenonanoic acid

HCID 66874843Benzyl 3-amino-4-(dimethylamino)butanoate

생성물 1

HCID 66874804Benzyl 4-(dimethylamino)-3-(9-pyridin-3-ylnonanoylamino)butanoate

출처 및 근거

ORD 기록: ord-ffc26fd378cb4f9ca1c5d50772e46f48
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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