Acetone → (E)-2,4,6-Trimethoxystyryl 3-Amino-4-Methoxybenzyl Sulfone

반응식

[CH3:1][O:2][c:3]1[c:4]([N+:27]([O-:28])=[O:29])[cH:5][c:6]([CH2:7][S:8](=[O:9])(=[O:10])[CH:11]=[CH:12][c:13]2[c:14]([O:23][CH3:24])[cH:15][c:16]([O:21][CH3:22])[cH:17][c:18]2[O:19][CH3:20])[cH:25][cH:26]1.[CH3:32][C:33]([CH3:34])=[O:35].[OH2:30].[OH2:31]>>[CH3:1][O:2][c:3]1[c:4]([NH2:27])[cH:5][c:6]([CH2:7][S:8](=[O:9])(=[O:10])[CH:11]=[CH:12][c:13]2[c:14]([O:23][CH3:24])[cH:15][c:16]([O:21][CH3:22])[cH:17][c:18]2[O:19][CH3:20])[cH:25][cH:26]1

참가 물질

반응물 3

HCID 180Acetone

HCID 962Water2회

HCID 729865261,3,5-Trimethoxy-2-[2-[(4-methoxy-3-nitro-phenyl)methylsulfonyl]vinyl]benzene

생성물 1

HCID 45835937(E)-2,4,6-Trimethoxystyryl 3-Amino-4-Methoxybenzyl Sulfone

출처 및 근거

ORD 기록: ord-7cc5d3bc52b04b07a913294e53173b90
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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