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Ononetin

更新时间:2025-08-25 19:07:05

Ononetin结构式
Ononetin结构式
品牌特惠专场
常用名 Ononetin 英文名 Ononetin
CAS号 487-49-0 分子量 258.26900
密度 1.275g/cm3 沸点 464.7ºC at 760mmHg
分子式 C15H14O4 熔点 158.0-162.0°C
MSDS N/A 闪点 176.9ºC

 Ononetin用途


Ononetin是一种天然脱氧苯偶姻,是一种有效的选择性TRPM3通道阻滞剂,IC50为0.3μM[1]。

 Ononetin名称

中文名 2',4'-二羟基-2-(4-甲氧基苯基)乙酰苯
英文名 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone
英文别名 更多

 Ononetin生物活性

描述 Ononetin是一种天然脱氧苯偶姻,是一种有效的选择性TRPM3通道阻滞剂,IC50为0.3μM[1]。
相关类别
靶点实验

TRPM3:0.3 μM (IC50)

体外研究 Ononetin(1-10μM)通过重组表达的TRPM3α2完全可逆地消除Ca2+进入和离子电流,并在小鼠或大鼠背根神经节(DRG)神经元的原代培养中阻断孕烯醇酮硫酸盐诱导的Ca2+进入,表明对内源性表达的TRPM3具有生物活性[1]。Ononetin的氧化中间体可能参与激活TRPA1,但不参与Ononetin阻断TRPM3[1]。
体内研究 Ononetin(10 mg/kg,i.p.)治疗完全逆转已建立的弗氏完全佐剂(FCA)诱导的热超敏反应,表明Trpm3-/-小鼠的超敏反应丧失不太可能是由发育或代偿机制引起的,并表明Trpm3可能是炎性疼痛的易处理靶点[2]。
参考文献

[1]. I Straub, et al. Citrus fruit and fabacea secondary metabolites potently and selectively block TRPM3. Br J Pharmacol. 2013 Apr;168(8):1835-50.

[2]. Omar Alkhatib, et al. Promiscuous G-Protein-Coupled Receptor Inhibition of Transient Receptor Potential Melastatin 3 Ion Channels by Gβγ Subunits. J Neurosci. 2019 Oct 2;39(40):7840-7852.

 Ononetin物理化学性质

密度 1.275g/cm3
沸点 464.7ºC at 760mmHg
熔点 158.0-162.0°C
分子式 C15H14O4
分子量 258.26900
闪点 176.9ºC
精确质量 258.08900
PSA 66.76000
LogP 2.53180
InChIKey XHBZOAYMBBUURD-UHFFFAOYSA-N
SMILES COc1ccc(CC(=O)c2ccc(O)cc2O)cc1
蒸汽压 2.95E-09mmHg at 25°C
折射率 1.62
储存条件 室温

 Ononetin安全信息

海关编码 2914509090

 Ononetin合成线路

~10%

Ononetin结构式

Ononetin

487-49-0

文献:Waehaelae, Kristiina; Hase, Tapio A. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1991 , # 12 p. 3005 - 3008

~55%

Ononetin结构式

Ononetin

487-49-0

文献:HANBUL COSMETIC CO., LTD. Patent: WO2005/54169 A1, 2005 ; Location in patent: Page/Page column 8; 9 ;

~94%

Ononetin结构式

Ononetin

487-49-0

文献:Pazenok, Sergii; Lui, Norbert Patent: US2010/121082 A1, 2010 ; Location in patent: Page/Page column 2 ;

~%

Ononetin结构式

Ononetin

487-49-0

文献:Walz Justus Liebigs Annalen der Chemie, 1931 , vol. 489, p. 118,127, 140

~%

Ononetin结构式

Ononetin

487-49-0

文献:Virtanen; Hietala Acta Chemica Scandinavica (1947-1973), 1958 , vol. 12, p. 579 Full Text Show Details Bradbury; White Journal of the Chemical Society, 1951 , p. 3447 Full Text Show Details Bose; Siddiqui Journal of Scientific and Industrial Research, 1951 , vol. 10 B, p. 291,292

~%

Ononetin结构式

Ononetin

487-49-0

文献:Whalley Journal of the Chemical Society, 1957 , p. 1833,1834

~%

Ononetin结构式

Ononetin

487-49-0

文献:Whalley Journal of the Chemical Society, 1957 , p. 1833,1834

~%

Ononetin结构式

Ononetin

487-49-0

文献:Baker; Eastwood Journal of the Chemical Society, 1929 , p. 2907

~%

Ononetin结构式

Ononetin

487-49-0

文献:Whalley Journal of the Chemical Society, 1957 , p. 1833,1834

 Ononetin海关

海关编码 2914509090
中文概述 2914509090 含其他含氧基的酮. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素 品名, 成分含量, 用途, 丙酮报明包装
Summary HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Ononetin靶点实验

查看更多实验

实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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:ERK5 transcriptional activity HTS
来源:24565
靶标:N/A
External Id:ERK5 transcriptional activity-HTS
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:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
实验名称:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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
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 Ononetin英文别名

Phenobarbital sodium salt
2,4-dihydroxy-4'-methoxy deoxybenzoin
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