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Bicarbonate Ion → methyl 4-methyl-6-[7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-6-(trifluoromethylsulfonyloxy)-1H-2-benzofuran-5-yl]hex-4-enoate

HRID 935318
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HRID 935318 반응식
[C:55](=[O:56])([OH:57])[O-:58].[CH2:60]([Cl:61])[Cl:62].[F:1][C:2]([S:3](=[O:4])(=[O:5])[O:8][S:9](=[O:10])(=[O:11])[C:12]([F:13])([F:14])[F:15])([F:6])[F:7].[Na+:59].[OH:16][c:17]1[c:18]([CH2:39][CH:40]=[C:41]([CH2:42][CH2:43][C:44](=[O:45])[O:46][CH3:47])[CH3:48])[c:19]([O:28][S:29](=[O:30])(=[O:31])[c:32]2[cH:33][cH:34][c:35]([CH3:38])[cH:36][cH:37]2)[c:20]2[c:24]([c:25]1[CH3:26])[CH2:23][O:22][C:21]2=[O:27].[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[O:8]([S:9](=[O:10])(=[O:11])[C:12]([F:13])([F:14])[F:15])[c:17]1[c:18]([CH2:39][CH:40]=[C:41]([CH2:42][CH2:43][C:44](=[O:45])[O:46][CH3:47])[CH3:48])[c:19]([O:28][S:29](=[O:30])(=[O:31])[c:32]2[cH:33][cH:34][c:35]([CH3:38])[cH:36][cH:37]2)[c:20]2[c:24]([c:25]1[CH3:26])[CH2:23][O:22][C:21]2=[O:27]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 1049PyridineHCID 6344DichloromethaneHCID 67749Trifluoromethanesulfonic anhydrideHCID 57018953methyl 6-[6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoate

생성물 1

HCID 57257837
methyl 4-methyl-6-[7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-6-(trifluoromethylsulfonyloxy)-1H-2-benzofuran-5-yl]hex-4-enoate

출처 및 근거

ORD 기록
ord-285b51b10df74fc39b275e094ab067e6
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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