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Carbonate Ion → 4-[3-[6-(3-Acetyl-5-thiophen-3-yl-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

HRID 305567
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인쇄 미리보기

반응식

HRID 305567 반응식
[C:48](=[O:49])([O-:50])[O-:51].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:32][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][c:22]2[cH:23][c:24]([C:29]([CH3:30])=[O:31])[cH:25][c:26]([Br:28])[cH:27]2)[cH:12][cH:13][cH:14]1)=[O:39].[Cs+:52].[Cs+:53].[s:40]1[cH:41][c:42]([B:45]([OH:46])[OH:47])[cH:43][cH:44]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][O:8][c:9]1[c:10]([CH2:32][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[c:11]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][c:22]2[cH:23][c:24]([C:29]([CH3:30])=[O:31])[cH:25][c:26](-[c:42]3[cH:41][s:40][cH:44][cH:43]3)[cH:27]2)[cH:12][cH:13][cH:14]1)=[O:39]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 581760Thiophene-3-boronic acidHCID 594968364-[3-[6-(3-Acetyl-5-bromo-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

생성물 1

HCID 594968154-[3-[6-(3-Acetyl-5-thiophen-3-yl-phenoxy)-hexyl]-2-(2-ethoxycarbonyl-ethyl)-phenoxy]-butyric acid ethyl ester

출처 및 근거

ORD 기록
ord-71c679487e69488ea065af9138b59f5d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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