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Sodium Ion → 8-(2,3-Dihydroxypropyl)-7-methoxy-2,2-dimethyl-4-oxochroman

HRID 2337061
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HRID 2337061 반응식
[C:26]([OH:27])([CH3:28])([CH3:29])[CH3:30].[CH2:1]([CH:2]=[CH2:3])[c:4]1[c:5]([O:17][CH3:18])[cH:6][cH:7][c:8]2[c:13]1[O:12][C:11]([CH3:14])([CH3:15])[CH2:10][C:9]2=[O:16].[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[Na+:23].[Na+:24].[OH2:25].[S:19](=[O:20])([O-:21])[O-:22]>>[CH2:1]([CH:2]([CH2:3][OH:20])[OH:25])[c:4]1[c:5]([O:17][CH3:18])[cH:6][cH:7][c:8]2[c:13]1[O:12][C:11]([CH3:14])([CH3:15])[CH2:10][C:9]2=[O:16]
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참가 물질

7

반응물 6

HCID 923Sodium Ion2회HCID 962WaterHCID 1099SulfiteHCID 6386tert-ButanolHCID 8857Ethyl AcetateHCID 576828728-Allyl-7-methoxy-2,2-dimethyl-4-oxochroman

생성물 1

HCID 576828558-(2,3-Dihydroxypropyl)-7-methoxy-2,2-dimethyl-4-oxochroman

출처 및 근거

ORD 기록
ord-9643d62a6eec4ac4862a95a5a1c632ad
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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