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Citric Acid → (+/-)-2-Methoxy-3-{[5-(4-methoxyphenyl)-6-phenylfuro[2,3-d]pyrimidin-4-yl]oxy}propan-1-ol

HRID 1536601
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HRID 1536601 반응식
[C:50]([O:51][CH3:52])([CH3:53])([CH3:54])[CH3:55].[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:1][O:2][CH:3]([CH2:4][OH:5])[CH2:6][OH:7].[Cl:8][c:9]1[c:10]2[c:11]([n:12][cH:13][n:14]1)[o:15][c:16](-[c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[c:17]2-[c:18]1[cH:19][cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]1.[OH2:56].[OH:32][C:33]([CH2:34][C:35]([C:36](=[O:37])[OH:38])([CH2:39][C:40](=[O:41])[OH:42])[OH:43])=[O:44]>>[CH3:1][O:2][CH:3]([CH2:4][OH:5])[CH2:6][O:7][c:9]1[c:10]2[c:11]([n:12][cH:13][n:14]1)[o:15][c:16](-[c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[c:17]2-[c:18]1[cH:19][cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 311Citric AcidHCID 962WaterHCID 8028TetrahydrofuranHCID 15413tert-Butyl methyl etherHCID 111709312-Methoxypropane-1,3-diolHCID 580168154-Chloro-5-(4-methoxyphenyl)-6-phenylfuro[2,3-d]pyrimidine

생성물 1

HCID 58016954
(+/-)-2-Methoxy-3-{[5-(4-methoxyphenyl)-6-phenylfuro[2,3-d]pyrimidin-4-yl]oxy}propan-1-ol

출처 및 근거

ORD 기록
ord-aa57487dac8f4222806ba971410eeb5a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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