4-(Pyrrolidin-1-yl)butan-1-ol → 4-(Pyrrolidin-1-yl)butyl 2-(4-((2-amino-4-(butylamino)-6-methylpyrimidin-5-yl)methyl)-3-hydroxyphenyl)acetate

HRID 175918

반응식

HRID 175918 반응식
[N:26]1([CH2:31][CH2:32][CH2:33][CH2:34][OH:35])[CH2:27][CH2:28][CH2:29][CH2:30]1.[NH2:1][c:2]1[n:3][c:4]([CH3:25])[c:5]([CH2:13][c:14]2[c:15]([OH:24])[cH:16][c:17]([CH2:20][C:21](=[O:22])[OH:23])[cH:18][cH:19]2)[c:6]([NH:8][CH2:9][CH2:10][CH2:11][CH3:12])[n:7]1>>[NH2:1][c:2]1[n:3][c:4]([CH3:25])[c:5]([CH2:13][c:14]2[c:15]([OH:24])[cH:16][c:17]([CH2:20][C:21](=[O:22])[O:23][CH2:34][CH2:33][CH2:32][CH2:31][N:26]3[CH2:27][CH2:28][CH2:29][CH2:30]3)[cH:18][cH:19]2)[c:6]([NH:8][CH2:9][CH2:10][CH2:11][CH3:12])[n:7]1

참가 물질

3

반응물 2

HCID 131719524-(Pyrrolidin-1-yl)butan-1-olHCID 684141362-(4-((2-Amino-4-(butylamino)-6-methylpyrimidin-5-yl)methyl)-3-hydroxyphenyl)acetic acid

생성물 1

HCID 426136814-(Pyrrolidin-1-yl)butyl 2-(4-((2-amino-4-(butylamino)-6-methylpyrimidin-5-yl)methyl)-3-hydroxyphenyl)acetate

출처 및 근거

ORD 기록
ord-582b77b00c3543c8988c917872c71058
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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