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4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid

更新时间:2025-09-27 10:27:07

4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid结构式
4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid结构式
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常用名 4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid 英文名 4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid
CAS号 41303-68-8 分子量 358.34200
密度 1.33g/cm3 沸点 588.2ºC at 760 mmHg
分子式 C19H18O7 熔点 N/A
MSDS N/A 闪点 213.2ºC

 名称

英文名 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-4-oxobutanoic acid

 物理化学性质

密度 1.33g/cm3
沸点 588.2ºC at 760 mmHg
分子式 C19H18O7
分子量 358.34200
闪点 213.2ºC
精确质量 358.10500
PSA 91.29000
LogP 2.87370
InChIKey NBFZNUCGNPYQHC-UHFFFAOYSA-N
SMILES COc1ccc(C(CC(=O)c2ccc3c(c2)OCO3)C(=O)O)cc1OC
折射率 1.592

 安全信息

海关编码 2932999099

 合成线路

~%

4-benzo[1,3]dioxol-5-yl-2-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid结构式

4-benzo[1,3]dio...

41303-68-8

文献:Ishii; Kawanabe; Harada; et al. Chemical and Pharmaceutical Bulletin, 1983 , vol. 31, # 9 p. 3039 - 3055

 上下游产品

上游产品  1

下游产品  0

 海关

海关编码 2932999099
中文概述 2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素 品名, 成分含量, 用途
Summary 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 靶点实验

查看更多实验

实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
实验名称:qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
来源:NCGC
靶标:TDP1 protein [Homo sapiens]
External Id:TDP1100
实验名称:qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
来源:NCGC
靶标:TDP1 protein [Homo sapiens]
External Id:TDP1101
实验名称:Inhibition of PI3Kgamma (unknown origin) assessed as decrease in fluorescence intensi...
来源:ChEMBL
靶标:Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
External Id:CHEMBL3366679
实验名称:Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
来源:Broad Institute
靶标:N/A
External Id:2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
实验名称:Inhibition of PI3Kgamma (unknown origin) assessed as decrease in fluorescence intensi...
来源:ChEMBL
靶标:Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
External Id:CHEMBL3366680
实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
实验名称:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_Inhibitor_SinglePoint_HTS_Activity
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