Methyl 4-aminobutanoate → methyl N-[N-(p-chlorobenzoyl)-4-(2,6-dimethylanilino)butyryl]-4-aminobutyrate

반응식

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

참가 물질

반응물 2

HCID 18614Methyl 4-aminobutanoate

HCID 35383Butyric acid, 4-(p-chloro-N-2,6-xylylbenzamido)-

생성물 1

HCID 20292236methyl N-[N-(p-chlorobenzoyl)-4-(2,6-dimethylanilino)butyryl]-4-aminobutyrate

출처 및 근거

ORD 기록: ord-8bc62ca81d9241d5aa43eb28eb4e6129
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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