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5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate

更新时间:2025-09-05 14:33:20

5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate结构式
5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate结构式
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常用名 5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate 英文名 5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate
CAS号 6320-37-2 分子量 398.36300
密度 1.36g/cm3 沸点 578.7ºC at 760 mmHg
分子式 C21H18O8 熔点 N/A
MSDS N/A 闪点 253.2ºC

 名称

英文名 [5-acetyloxy-3-methoxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl] acetate

 物理化学性质

密度 1.36g/cm3
沸点 578.7ºC at 760 mmHg
分子式 C21H18O8
分子量 398.36300
闪点 253.2ºC
精确质量 398.10000
PSA 101.27000
LogP 3.32780
InChIKey OXRCQEMNONCHMK-UHFFFAOYSA-N
SMILES COc1ccc(-c2oc3cc(OC(C)=O)cc(OC(C)=O)c3c(=O)c2OC)cc1
折射率 1.6

 合成线路

~%

5-(Acetyloxy)-3-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate结构式

5-(Acetyloxy)-3...

6320-37-2

文献:Zemplen; Bognar Chemische Berichte, 1941 , vol. 74, p. 1783,1786

 上下游产品

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下游产品  0

 靶点实验

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External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
实验名称:In vitro cytotoxic potency against NCI-60 human tumor cell line
来源:ChEMBL
靶标:Panel NCI-60 (60 carcinoma cell lines)
External Id:CHEMBL749609
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来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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来源:Broad Institute
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External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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External Id:SIAE_INH_FP_1536_1X%INH PRUN
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来源:Burnham Center for Chemical Genomics
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External Id:SBCCG-A1015-NR3A-Primary-Assay
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靶标:N/A
External Id:SBCCG-A1016-RevErbaLBD-Primary-Assay
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