| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| A424246-1ml |
1ml |
现货  |
|
| 英文别名 | HY-114009 | 3-Bromo-5-phenylsalicylc acid | E76500 | S0764 | 3-Bromo-5-phenyl salicylic acid | AKOS005151372 | 3-bromo-5-phenylsalicyclic acid | LG-0054 | 5-Bromo-4-hydroxy-[1,1'-biphenyl]-3-carboxylic acid | XVZSXNULHSIRCQ-UHFFFAOYSA-N | 3-bromo-5-phenyl |
|---|---|
| 规格或纯度 | 10mM in DMSO |
| 英文名称 | AKR1C1-IN-1 |
| 生化机理 | AKR1C1-IN-1 是一种强效的人 20α- 羟类固醇脱氢酶（AKR1C1）选择性抑制剂，对 AKR1C1、AKR1C2、AKR1C3 和 AKR1C4 的 Ki 值分别为 4 nM、87 nM、4.2 μM 和 18.2 μM。 |
| 储存温度 | -80℃储存 |
| 运输条件 | 超低温冰袋运输 |
| 作用类型 | 抑制剂 |
| 产品介绍 |
Information AKR1C1-IN-1 AKR1C1-IN-1 is a potent and selective inhibitor of human 20alpha-hydroxysteroid dehydrogenase (AKR1C1) with Ki of 4 nM, 87 nM, 4.2 μM and 18.2 μM for AKR1C1, AKR1C2, AKR1C3 and AKR1C4, respectively. Targets AKR1C1 (Cell-free assay); AKR1C2 (Cell-free assay); AKR1C3 (Cell-free assay); AKR1C4 (Cell-free assay) 4 nM(Ki); 87 nM(Ki); 4.2 μM(Ki); 18.2 μM(Ki) |
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
| 分子类型 | 小分子 |
|---|---|
| IIUPAC Name | 3-bromo-2-hydroxy-5-phenylbenzoic acid |
| INCHI | 1S/C13H9BrO3/c14-11-7-9(8-4-2-1-3-5-8)6-10(12(11)15)13(16)17/h1-7,15H,(H,16,17) |
| InChi Key | XVZSXNULHSIRCQ-UHFFFAOYSA-N |
| Smiles | C1=CC=C(C=C1)C2=CC(=C(C(=C2)Br)O)C(=O)O |
| Isomeric SMILES | C1=CC=C(C=C1)C2=CC(=C(C(=C2)Br)O)C(=O)O |
| 分子量 | 293.12 |
| Reaxy-Rn | 2850361 |
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2850361&ln= |
| 分子量 | 293.110 g/mol |
|---|---|
| XLogP3 | 4.000 |
| 氢键供体数Hydrogen Bond Donor Count | 2 |
| 氢键受体数Hydrogen Bond Acceptor Count | 3 |
| 可旋转键计数Rotatable Bond Count | 2 |
| 精确质量Exact Mass | 291.974 Da |
| 单同位素质量Monoisotopic Mass | 291.974 Da |
| 拓扑极表面积Topological Polar Surface Area | 57.500 Ų |
| 重原子数Heavy Atom Count | 17 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 276.000 |
| 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 | 0 |
| 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 |
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