2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one

• ChemBase编号: 74436
• 分子式: C15H10O7
• 平均质量: 302.2357
• 单一同位素质量: 302.04265266
• SMILES: o1c2c(c(cc(c2)O)O)c(=O)c(c1c1c(cc(cc1)O)O)O
• Canonical SMILES: Oc1ccc(c(c1)O)c1oc2cc(O)cc(c2c(=O)c1O)O
• InChI: InChI=1S/C15H10O7/c16-6-1-2-8(9(18)3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,16-19,21H
• InChIKey: YXOLAZRVSSWPPT-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one
• IUPAC传统名: 2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one; bois d,arc
• 别名: 2′,3,4′,5,7-五羟黄酮; 桑色素; 铝离子载体 I; 2′,3,4′,5,7-Pentahydroxyflavone; Morin; Aluminum Ionophore I; 2',4',5,7-Tetrahydroxyflavonol; 2'-Hydroxypelargidenolon 1522; C.I. Natural yellow 8; C.I. Natural yellow 11; Morin; MORIN, REAGENT GRADE; Aurantica; Al-Morin; Morin hydrate; Calico Yellow; Toxylon pomiferum; Bois d'arc; Osage orange extract; Morin (flavonol); Morin

登记号

• CAS号: 654055-01-3; 480-16-0
• EC号: 207-542-9
• MDL号: MFCD00006826
• PubChem SID: 162039355
• PubChem CID: 5281670
• CHEMBL: 28626
• Chemspider ID: 4444989
• IUPHAR配体索引: 411
• KEGG ID: C10105
• 维基百科标题: Morin_(flavonol)

理论计算性质

• Acid pKa: 6.428466
• 质子受体: 7
• 质子供体: 5
• LogD (pH = 5.5): 2.1080854
• LogD (pH = 7.4): 1.0575035
• Log P: 2.1562994
• 摩尔折射率: 76.8622 cm^3
• 极化性: 28.418543 Å^3
• 极化表面积: 127.45 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

理化性质

• 密度: 1.799 g/mL

安全信息

• 保存条件: Room Temperature (15-30°C)
• RTECS编号: LK8749000
• 欧盟危险性物质标志: 有毒(Toxic) (T)
• 德国WGK号: 3
• 危险公开号: 25
• 安全公开号: 45
• GHS危险品标识: GHS06
• GHS警示词: Danger
• GHS危险声明: H301
• GHS警示性声明: P301 + P310
• 个人保护装置: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

药理学性质

• 生物活性机理: Lipid-peroxidation inhibitor in rat liver microsomes

产品相关信息

• 级别: REAGENT; Selectophore™
• 生物来源: Constit. of various woods, e.g. Morus alba. First isol. in 1830
• 应用领域: Antiinflammatory; Bioflavonoid; Shows antiperoxidative activity in vitro and anti-HIV activity
• 品质说明: function tested
• Empirical Formula (Hill Notation): C15H10O7

详细说明

MP Biomedicals - 02155733

C.I. 75660 (2',3,4',5,7-Pentahydroxyflavone)

MP Biomedicals - 05204582

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 55593

Application
用于制作铝离子选择性电位传感器1
General description
请访问 传感器应用门户网站 了解更多信息。
法律信息
Selectophore 商标 Sigma-Aldrich GmbH

参考文献

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