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I2209316
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| 活性类型 | 活性值-log(M) | 作用机制 | 期刊 | 参考文献(PubMed IDs) |
|---|
牛蒡子苷元
有货
库存信息
| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| A109806-20mg |
20mg |
现货  |
|
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基本描述
| 别名 | 牛蒡甙元 | 牛蒡苷元 | (-)-牛蒡子苷元 | (3R,4R)-4-[(3,4-二甲氧基苯基)甲基]二氢-3-[(4-羟基-3-甲氧基苯基)甲基]-2(3H)-呋喃酮 | (3,4）-4-[（3,4-二甲氧基苯基）甲基]二氢-3-[（4-羟基-3-甲氧基苯基）甲基]-2（3H）-呋喃酮 |
|---|---|
| 英文别名 | 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)dihydro-3-((4-hydroxy-3-methoxyphenyl)methyl)-, (3R-trans)- | SCHEMBL381820 | (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxolan-2-one | (3R,4R)-4-[(3,4-dimethoxyphenyl)meth |
| 规格或纯度 | 分析标准品, ≥98% |
| 英文名称 | (-)-Arctigenin |
| 生化机理 | 二苄基丁内酯配体，天然产物，病毒整合酶和拓扑异构酶 II 抑制剂，抗氧化剂，抗病毒，抗炎，免疫调节剂。 |
| 储存温度 | -20°C储存 |
| 运输条件 | 超低温冰袋运输 |
| 产品介绍 |
Arctigenin is a lignan found in the root of Arctium lappa L. It has been used in pharmacologic, as well as cosmetic, research and has demonstrated several antiviral and anticancer effects. Arctigenin is a lignan found in the root of Arctium lappa L. It has been used in pharmacologic, as well as cosmetic, research and has demonstrated several antiviral and anticancer effects. |
AI解读
关联靶点（人）
CYP2C19
Tchem
细胞色素 P450 2C19(Cytochrome P450 2C19)
(1 活性数据)
MAP2K1
Tclin
双特异性丝裂原活化蛋白激酶激酶 1(Dual specificity mitogen-activated protein kinase kinase 1)
(1 活性数据)
DAPK3
Tchem
Death-associated protein kinase 3
(2108 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAPK11
Tchem
MAP kinase p38 beta
(2785 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
GSK3B
Tclin
Glycogen synthase kinase-3 beta
(11785 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAP2K6
Tchem
Dual specificity mitogen-activated protein kinase kinase 6
(1284 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CSNK1G1
Tchem
Casein kinase I gamma 1
(2496 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK2B
Tchem
CaM kinase II beta
(1626 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CDK6
Tclin
Cyclin-dependent kinase 6
(1724 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CHEK2
Tchem
Serine/threonine-protein kinase Chk2
(4015 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PDPK1
Tchem
3-phosphoinositide dependent protein kinase-1
(3758 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
APP
Tclin
Amyloid-beta A4 protein
(8510 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PRKAA2
Tchem
AMP-activated protein kinase, alpha-2 subunit
(1328 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PIM1
Tchem
Serine/threonine-protein kinase PIM1
(9629 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PLK1
Tchem
Serine/threonine-protein kinase PLK1
(28605 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
JAK1
Tclin
Tyrosine-protein kinase JAK1
(8569 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK4
Tbio
CaM kinase IV
(2116 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAP2K2
Tclin
Dual specificity mitogen-activated protein kinase kinase 2
(1262 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CYP2D6
Tclin
Cytochrome P450 2D6
(33882 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAP2K1
Tclin
Dual specificity mitogen-activated protein kinase kinase 1
(4127 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK2D
Tchem
CaM kinase II delta
(2813 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CSNK1G2
Tchem
Casein kinase I gamma 2
(2539 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAPK3
Tchem
MAP kinase ERK1
(4725 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CDK2
Tchem
Cyclin-dependent kinase 2
(9050 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PRKACA
Tchem
cAMP-dependent protein kinase alpha-catalytic subunit
(3475 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK2A
Tchem
CaM kinase II alpha
(1938 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CYP1A2
Tchem
Cytochrome P450 1A2
(26471 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
RPS6KA3
Tchem
Ribosomal protein S6 kinase alpha 3
(4284 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CYP2C9
Tchem
Cytochrome P450 2C9
(32119 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CYP2C19
Tchem
Cytochrome P450 2C19
(29246 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CYP3A4
Tclin
Cytochrome P450 3A4
(53859 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PLK4
Tchem
Serine/threonine-protein kinase PLK4
(1882 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
STK16
Tchem
Serine/threonine-protein kinase 16
(910 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
STK10
Tchem
Serine/threonine-protein kinase 10
(2119 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CLK1
Tchem
Dual specificty protein kinase CLK1
(2189 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CLK2
Tchem
Dual specificity protein kinase CLK2
(3942 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CLK3
Tchem
Dual specificity protein kinase CLK3
(2711 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
NEK2
Tchem
Serine/threonine-protein kinase NEK2
(3514 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CDK16
Tchem
Serine/threonine-protein kinase PCTAIRE-1
(829 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
STK4
Tchem
Serine/threonine-protein kinase MST1
(2643 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK1D
Tchem
CaM kinase I delta
(2141 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMK1G
Tchem
CaM kinase I gamma
(570 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAMKK2
Tchem
CaM-kinase kinase beta
(1281 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
MAP3K5
Tchem
Mitogen-activated protein kinase kinase kinase 5
(1965 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
SLK
Tchem
Serine/threonine-protein kinase 2
(1640 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
NEK6
Tchem
Serine/threonine-protein kinase NEK6
(1986 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PAK6
Tchem
Serine/threonine-protein kinase PAK6
(1915 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PIM2
Tchem
Serine/threonine-protein kinase PIM2
(5873 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
PAK5
Tchem
Serine/threonine-protein kinase PAK7
(1760 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
STK17A
Tchem
Serine/threonine-protein kinase 17A
(1791 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
TNIK
Tchem
TRAF2- and NCK-interacting kinase
(1174 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
CAPAN-1
(772 活性数据)
关联靶点（其它种属）
Mapk1
MAP kinase ERK2 (650 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Hdac6
Histone deacetylase 6 (222 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
pol
Human immunodeficiency virus type 1 integrase (9041 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Camk2g
CaM kinase II gamma (1 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Toxoplasma gondii (4585 活性数据)
Human betaherpesvirus 5 (5122 活性数据)
Mus musculus (284745 活性数据)
Human immunodeficiency virus 1 (70413 活性数据)
Human immunodeficiency virus (3636 活性数据)
RAW264.7 (28094 活性数据)
L6 (7924 活性数据)
rep
Replicase polyprotein 1ab (378 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Rorc
Nuclear receptor ROR-gamma (89407 活性数据)
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
SARS-CoV-2 (38078 活性数据)
作用机制
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
名称和识别符
| 分子类型 | 小分子 |
|---|---|
| IUPAC Name | (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one |
| INCHI | InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1 |
| InChi Key | NQWVSMVXKMHKTF-JKSUJKDBSA-N |
| Canonical SMILES | COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)OC |
| Isomeric SMILES | COC1=C(C=C(C=C1)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O)OC)OC |
| WGK Germany | 3 |
| PubChem CID | 64981 |
| 分子量 | 372.41 |
化学和物理性质
| 密度 | 1.227 |
|---|---|
| 敏感性 | 对热敏感 |
| 比旋光度 | -42° (C=1,MeOH) |
| 熔点 | 100 °C |
| 分子量 | 372.400 g/mol |
| XLogP3 | 3.600 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 6 |
| 可旋转键计数Rotatable Bond Count | 7 |
| 精确质量Exact Mass | 372.157 Da |
| 单同位素质量Monoisotopic Mass | 372.157 Da |
| 拓扑极表面积Topological Polar Surface Area | 74.200 Ų |
| 重原子数Heavy Atom Count | 27 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 483.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 2 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
安全和危险性（GHS）
| WGK Germany | 3 |
|---|
技术规格说明书
| Purity(HPLC) | 98-100（%） |
|---|---|
| Appearance（A109806) | White to Off-White Powder |
| Infrared spectrum | Conforms to Structure |
| Proton NMR spectrum | Conforms to Structure |
质检证书（CoA,COO,BSE/TSE 和分析图谱)
此产品的引用文献
| 1. Yang Hu, Huan Wang, Lei Liu, Jia-yun Yao, Jiong Chen. (2022) Evaluation on the antiviral effect of natural product arctigenin against Micropterus salmoides rhabdovirus (MSRV) in vitro and in vivo. AQUACULTURE, 560 (738495). [10.1016/j.aquaculture.2022.738495] |
| 2. Jingyi Zhao, Ying Chen, Lijun Dong, Xin Li, Ruijie Dong, Dongmei Zhou, Chengzhi Wang, Xiangdong Guo, Jieyou Zhang, Zhenyi Xue, Qing Xi, Lijuan Zhang, Guangze Yang, Yan Li, Rongxin Zhang. (2020) Arctigenin protects mice from thioglycollate-induced acute peritonitis. Pharmacology Research & Perspectives, 8 (5): (e00660). [PMID:32960513] [10.1002/prp2.660] |
| 3. Yu-Feng Shen, Yi-Hang Liu, Bo-Yang Li, Tian-Qiang Liu, Gao-Xue Wang. (2020) Evaluation on antiviral activity of a novel arctigenin derivative against multiple rhabdoviruses in aquaculture. VIRUS RESEARCH, 285 (198019). [PMID:32417180] [10.1016/j.virusres.2020.198019] |
| 4. Wenjing Wang, Lu Wang, Lina Zou, Gaiping Li, Baoxian Ye. (2016) Electrochemical behavior of arctigenin at a novel voltammetric sensor based on Iodide/SWCNTs composite film modified electrode and its sensitive determination. JOURNAL OF ELECTROANALYTICAL CHEMISTRY, 772 (17). [10.1016/j.jelechem.2016.04.002] |
参考文献
| 1. Yang Hu, Huan Wang, Lei Liu, Jia-yun Yao, Jiong Chen. (2022) Evaluation on the antiviral effect of natural product arctigenin against Micropterus salmoides rhabdovirus (MSRV) in vitro and in vivo. AQUACULTURE, 560 (738495). [10.1016/j.aquaculture.2022.738495] |
| 2. Jingyi Zhao, Ying Chen, Lijun Dong, Xin Li, Ruijie Dong, Dongmei Zhou, Chengzhi Wang, Xiangdong Guo, Jieyou Zhang, Zhenyi Xue, Qing Xi, Lijuan Zhang, Guangze Yang, Yan Li, Rongxin Zhang. (2020) Arctigenin protects mice from thioglycollate-induced acute peritonitis. Pharmacology Research & Perspectives, 8 (5): (e00660). [PMID:32960513] [10.1002/prp2.660] |
| 3. Yu-Feng Shen, Yi-Hang Liu, Bo-Yang Li, Tian-Qiang Liu, Gao-Xue Wang. (2020) Evaluation on antiviral activity of a novel arctigenin derivative against multiple rhabdoviruses in aquaculture. VIRUS RESEARCH, 285 (198019). [PMID:32417180] [10.1016/j.virusres.2020.198019] |
| 4. Wenjing Wang, Lu Wang, Lina Zou, Gaiping Li, Baoxian Ye. (2016) Electrochemical behavior of arctigenin at a novel voltammetric sensor based on Iodide/SWCNTs composite film modified electrode and its sensitive determination. JOURNAL OF ELECTROANALYTICAL CHEMISTRY, 772 (17). [10.1016/j.jelechem.2016.04.002] |