N-(4-羟基苯基)乙酰胺结构式
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常用名 | N-(4-羟基苯基)乙酰胺 | 英文名 | N-Acetyltyramine |
|---|---|---|---|---|
| CAS号 | 1202-66-0 | 分子量 | 179.216 | |
| 密度 | 1.1±0.1 g/cm3 | 沸点 | 424.1±28.0 °C at 760 mmHg | |
| 分子式 | C10H13NO2 | 熔点 | 134°C | |
| MSDS | 中文版 美版 | 闪点 | 210.3±24.0 °C | |
| 符号 |
GHS05 |
信号词 | Danger |
N-(4-羟基苯基)乙酰胺用途N-Acetyltyramine 是溶藻弧菌 M3-10 产生的群体感应抑制剂 (QSI) 化合物。N-Acetyltyramine 能抑制 C. violaceum ATCC 12472 的群体感应 (QS)。N-Acetyltyramine 逆转阿霉素耐药白血病 P388 细胞的耐药性。 |
| 中文名 | N-乙酰基酪胺 |
|---|---|
| 英文名 | N-[2-(4-hydroxyphenyl)ethyl]acetamide |
| 中文别名 | N-(4-羟基苯乙基)乙酰胺 | N-[2-(4-羟基苯基)乙基]乙酰胺 |
| 英文别名 | 更多 |
| 描述 | N-Acetyltyramine 是溶藻弧菌 M3-10 产生的群体感应抑制剂 (QSI) 化合物。N-Acetyltyramine 能抑制 C. violaceum ATCC 12472 的群体感应 (QS)。N-Acetyltyramine 逆转阿霉素耐药白血病 P388 细胞的耐药性。 |
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| 相关类别 | |
| 体外研究 | N-乙酰酪胺增强了耐药P388小鼠白血病细胞中阿霉素的细胞毒性,IC50值为0.13μg/ml,而单用阿霉素的IC50值为0.48µg/ml[2]。 |
| 参考文献 |
| 密度 | 1.1±0.1 g/cm3 |
|---|---|
| 沸点 | 424.1±28.0 °C at 760 mmHg |
| 熔点 | 134°C |
| 分子式 | C10H13NO2 |
| 分子量 | 179.216 |
| 闪点 | 210.3±24.0 °C |
| 精确质量 | 179.094635 |
| PSA | 49.33000 |
| LogP | 0.39 |
| InChIKey | ATDWJOOPFDQZNK-UHFFFAOYSA-N |
| SMILES | CC(=O)NCCc1ccc(O)cc1 |
| 外观性状 | 灰白色 |
| 蒸汽压 | 0.0±1.0 mmHg at 25°C |
| 折射率 | 1.546 |
| 储存条件 | 2-8°C |
| 计算化学 | 1.疏水参数计算参考值(XlogP):1.1 2.氢键供体数量:2 3.氢键受体数量:2 4.可旋转化学键数量:3 5.互变异构体数量:4 6.拓扑分子极性表面积:49.3 7.重原子数量:13 8.表面电荷:0 9.复杂度:162 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
| 符号 |
GHS05 |
|---|---|
| 信号词 | Danger |
| 危害声明 | H318 |
| 警示性声明 | P280-P305 + P351 + P338 |
| 危害码 (欧洲) | Xi |
| 危险品运输编码 | NONH for all modes of transport |
| 海关编码 | 2924299090 |
| N-(4-羟基苯基)乙酰胺上游产品 9 | |
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| N-(4-羟基苯基)乙酰胺下游产品 6 | |
| 海关编码 | 2924299090 |
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| 中文概述 | 2924299090. 其他环酰胺(包括环氨基甲酸酯)(包括其衍生物以及他们的盐). 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:30.0% |
| 申报要素 | 品名, 成分含量, 用途, 包装 |
| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Selective nanomolar detection of dopamine using a boron-doped diamond electrode modified with an electropolymerized sulfobutylether-beta-cyclodextrin-doped poly(N-acetyltyramine) and polypyrrole composite film.
Anal. Chem. 81(10) , 4089-98, (2009) N-acetyltyramine was synthesized and electropolymerized together with a negatively charged sulfobutylether-beta-cyclodextrin on a boron-doped diamond (BDD) electrode followed by the electropolymerizat... |
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Mechanistic and structural analysis of Drosophila melanogaster arylalkylamine N-acetyltransferases.
Biochemistry 53(49) , 7777-93, (2014) Arylalkylamine N-acetyltransferase (AANAT) catalyzes the penultimate step in the biosynthesis of melatonin and other N-acetylarylalkylamides from the corresponding arylalkylamine and acetyl-CoA. The N... |
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Effect of acetyl derivatives of some sympathomimetic amines on the blood pressure of the rat.
Acta Pharmacol. Toxicol. (Copenh.) 40(2) , 247-58, (1977) The effect of five sympathomimetic amines and some of their acetyl derivatives on the blood pressure of the rat was determined on the left carotid artery. After pretreatment with chlorisondamine (1 mg... |
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:USP8 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 8
External Id:USP8 FAST DUB HTS Primary
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:USP17 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 17 like family member 5
External Id:USP17 FAST DUB HTS Primary
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实验名称:USP7 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 7
External Id:USP7 FAST DUB HTS Primary
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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| GNF-PF-5230 |
| N-Acetyltyramine |
| N-acetyltyramin |
| N-[2-(4-Hydroxyphenyl)ethyl]acetamide |