Hydrochloric Acid → tert-butyl 2-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]hexanoate

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 12451445Tert-butyl 2-aminohexanoate

HCID 219429782-[[2-(3,5-Difluorophenyl)acetyl]amino]propanoic acid

생성물 1

HCID 178446586tert-butyl 2-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]hexanoate

출처 및 근거

ORD 기록: ord-2aac91753ccd4e478df8a58ac33f4951
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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