4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯

• 常用名: 4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯
• 英文名: ISO-1
• CAS号: 478336-92-4
• 分子量: 235.236
• 密度: 1.3±0.1 g/cm3
• 沸点: 365.0±48.0 °C at 760 mmHg
• 分子式: C₁₂H₁₃NO₄
• 熔点: 114 °C
• 闪点: 174.6±29.6 °C

用途

ISO-1是巨噬细胞移动抑制因子(MIF) 拮抗剂,IC50 为7 μM。

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯名称

• 中文名: 4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯
• 英文名: methyl 2-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-oxazolidin-5-yl]acetate

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯生物活性

• 描述: ISO-1是巨噬细胞移动抑制因子(MIF) 拮抗剂,IC50 为7 μM。
• 相关类别:
  信号通路 >> 其他 >> 其他
  研究领域 >> 炎症/免疫
• 参考文献:

  [1]. Lubetsky JB, et al. The tautomerase active site of macrophage migration inhibitory factor is a potential target for discovery of novel anti-inflammatory agents. J Biol Chem. 2002 Jul 12;277(28):24976-82.

  [2]. Al-Abed Y, et al. ISO-1 binding to the tautomerase active site of MIF inhibits its pro-inflammatory activity and increases survival in severe sepsis. J Biol Chem. 2005 Nov 4;280(44):36541-4.

  [3]. Nothnick WB, et al. Inhibition of macrophage migration inhibitory factor reduces endometriotic implant size in mice with experimentally induced disease. J Endometr. 2011 Sep 30;3(3):135-142.

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯物理化学性质

• 密度: 1.3±0.1 g/cm3
• 沸点: 365.0±48.0 °C at 760 mmHg
• 熔点: 114 °C
• 分子式: C₁₂H₁₃NO₄
• 分子量: 235.236
• 闪点: 174.6±29.6 °C
• 精确质量: 235.084457
• PSA: 64.63000
• LogP: 0.89
• InChIKey: AIXMJTYHQHQJLU-UHFFFAOYSA-N
• SMILES: COC(=O)CC1CC(c2ccc(O)cc2)=NO1
• 外观性状: 固体;White to Almost white powder to crystal
• 蒸汽压: 0.0±0.8 mmHg at 25°C
• 折射率: 1.582
• 储存条件: -20°C;存放于惰性气体之中;避免光,湿气 (吸湿),加热

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯安全信息

• 海关编码: 2934999090

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯海关

• 海关编码: 2934999090
• 中文概述: 2934999090. 其他杂环化合物. 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: 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

4,5-二氢-3-(4-羟基苯基)-5-异恶唑乙酸甲酯英文别名

• Methyl [3-(4-hydroxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetate
• UNII-7QFF3Z0V9X
• MIF Antagonist,ISO-1
• 5-Isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester
• 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO-5-ISOXAZOLE-ACETIC ACID METHYL ESTER
• 3-(4-hydroxyphenyl)-4,5-dihydro-5-isoxazoleacetic acid methyl ester
• UNII:7QFF3Z0V9X
• Macrophage Migration Inhibitory Factor Antagonist,ISO-1
• ISO-1