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Bicarbonate Ion → 6-(2-furyl)-N-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}-5H-pyrrolo[3,2-d]pyrimidin-4-amine

HRID 150230
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반응식

HRID 150230 반응식
[C:39](=[O:40])([O-:41])[OH:42].[CH3:16][c:17]1[cH:18][c:19]([NH2:20])[cH:21][cH:22][c:23]1[O:24][c:25]1[cH:26][n:27][c:28]([CH3:31])[cH:29][cH:30]1.[CH3:32][N:33]1[CH2:34][CH2:35][CH2:36][C:37]1=[O:38].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][c:9](-[c:11]1[o:12][cH:13][cH:14][cH:15]1)[nH:10]2.[Na+:43].[OH2:44]>>[c:2]1([NH:20][c:19]2[cH:18][c:17]([CH3:16])[c:23]([O:24][c:25]3[cH:26][n:27][c:28]([CH3:31])[cH:29][cH:30]3)[cH:22][cH:21]2)[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][c:9](-[c:11]1[o:12][cH:13][cH:14][cH:15]1)[nH:10]2
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반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 114244343-Methyl-4-((6-methylpyridin-3-yl)oxy)anilineHCID 713033474-chloro-6-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidine

생성물 1

HCID 57597196
6-(2-furyl)-N-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}-5H-pyrrolo[3,2-d]pyrimidin-4-amine

출처 및 근거

ORD 기록
ord-01e4352e9e23430d8b8319d8a36d5447
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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