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Methanol → 2-(3-Chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)propanoic acid

HRID 2150351
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HRID 2150351 반응식
[CH3:47][OH:48].[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[CH2:18][CH:19]2[CH2:20][C:21]3([O:22][CH:23]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH:24]([c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[O:25]3)[CH2:38][CH2:39]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11].[Na+:46].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:45]>>[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[OH:15])[CH2:18][CH:19]2[CH2:20][C:21]3([O:22][CH:23]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH:24]([c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[O:25]3)[CH2:38][CH2:39]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 72257174Ethyl 2-(3-chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)propanoate

생성물 1

HCID 722571642-(3-Chloro-4-methylsulfonylphenyl)-3-(2,3-diphenyl-1,4-dioxaspiro[4.4]nonan-8-yl)propanoic acid

출처 및 근거

ORD 기록
ord-0f1bb1646a1b4f06a78c99908720ef98
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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