N-(4-hydroxyphenyl)icosa-5,8,11,14-tetraenamide

• ChemBase编号: 155732
• 分子式: C26H37NO2
• 平均质量: 395.57748
• 单一同位素质量: 395.28242943
• SMILES: CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)Nc1ccc(cc1)O
• Canonical SMILES: CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)Nc1ccc(cc1)O
• InChI: InChI=1S/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)27-24-20-22-25(28)23-21-24/h6-7,9-10,12-13,15-16,20-23,28H,2-5,8,11,14,17-19H2,1H3,(H,27,29)
• InChIKey: IJBZOOZRAXHERC-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: N-(4-hydroxyphenyl)icosa-5,8,11,14-tetraenamide
• IUPAC传统名: N-(4-hydroxyphenyl)icosa-5,8,11,14-tetraenamide
• 别名: AM404; N-(4-Hydroxyphenyl)-arachidonylamide

登记号

• CAS号: 183718-77-6
• MDL号: MFCD03095721
• PubChem SID: 24895490; 162249870
• PubChem CID: 5353402

理论计算性质

• 摩尔折射率: 130.2122 cm^3
• 极化性: 48.05595 Å^3
• 极化表面积: 49.33 Å^2
• 可自由旋转的化学键: 15
• 里宾斯基五规则: false
• Acid pKa: 9.461591
• 质子受体: 2
• 质子供体: 2
• LogD (pH = 5.5): 7.71786
• LogD (pH = 7.4): 7.714177
• Log P: 7.7179074

分子性质

理化性质

• 外观: ethanol solution
• 闪点: 14 °C; 57.2 °F

安全信息

• 欧盟危险性物质标志: 易燃性(Flammable) (F)
• 联合国危险货物编号: 1170
• 德国WGK号: 2
• 联合国危险货物等级: 3
• 联合国危险货物包装类别(PG): 2
• 危险公开号: 11
• 安全公开号: 16
• GHS危险品标识: GHS02
• GHS警示词: Danger
• GHS危险声明: H225
• GHS警示性声明: P210
• 个人保护装置: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1170 3/PG 2
• 保存温度: -20°C

药理学性质

• 相关基因信息: human ... CNR1(1268), CNR2(1269)mouse ... Cnr2(12802)rat ... Cnr1(25248), Faah(29347), Trpv1(83810)

产品相关信息

• 纯度: ≥98%
• 运输包装: wet ice
• Empirical Formula (Hill Notation): C26H37NO2

详细说明

Sigma Aldrich - H1911

Other Notes
To change the solvent, simply evaporate the ethanol under a gentle stream of nitrogen and immediately add the solvent of choice.
Application
Potentiates the activity of endogenous anandamide by blocking its re-uptake into presynaptic membranes. AM404 selectively inhibits the carrier-mediated transport of anandamide without affecting anandamide hydrolysis.