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Ethanol → 3-[5-(Benzo[b]thien-2-yl)-2,4-di-methoxyphenyl]-1-(3,4,5-trimethoxyphenyl)-2-propen-1-one

HRID 122106
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HRID 122106 반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:13]([CH3:14])=[O:15])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:39][CH2:40][OH:41].[Na+:17].[OH-:16].[s:18]1[c:19]2[c:20]([cH:21][c:22]1-[c:23]1[c:24]([O:33][CH3:34])[cH:25][c:26]([O:31][CH3:32])[c:27]([CH:28]=[O:29])[cH:30]1)[cH:35][cH:36][cH:37][cH:38]2>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:13]([CH:14]=[CH:28][c:27]2[c:26]([O:31][CH3:32])[cH:25][c:24]([O:33][CH3:34])[c:23](-[c:22]3[s:18][c:19]4[c:20]([cH:21]3)[cH:35][cH:36][cH:37][cH:38]4)[cH:30]2)=[O:15])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 143453',4',5'-TrimethoxyacetophenoneHCID 161159165-Benzo[b]thiophen-2-yl-2,4-dimethoxy-benzaldehyde

생성물 1

HCID 694938793-[5-(Benzo[b]thien-2-yl)-2,4-di-methoxyphenyl]-1-(3,4,5-trimethoxyphenyl)-2-propen-1-one

출처 및 근거

ORD 기록
ord-ce3c57cf48b242d488a2701da8fa4247
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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