花椒毒酚,花椒毒醇

• 常用名: 花椒毒酚,花椒毒醇
• 英文名: Xanthotoxol
• CAS号: 2009-24-7
• 分子量: 202.163
• 密度: 1.5±0.1 g/cm3
• 沸点: 428.1±45.0 °C at 760 mmHg
• 分子式: C₁₁H₆O₄
• 熔点: 250ºC
• 闪点: 212.7±28.7 °C

花椒毒酚,花椒毒醇用途

Xanthotoxol 是一种具有生物活性的线性呋喃香豆素,有强烈的药理学活性,如抗炎,抗氧化,5-HT 拮抗和神经保护作用。

花椒毒酚,花椒毒醇名称

• 中文名: 花椒毒醇
• 英文名: Xanthotoxol
• 中文别名: 花椒毒酚 | 花椒毒酚 | 8-羟基补骨脂素

花椒毒酚,花椒毒醇生物活性

• 描述: Xanthotoxol 是一种具有生物活性的线性呋喃香豆素,有强烈的药理学活性,如抗炎,抗氧化,5-HT 拮抗和神经保护作用。
• 相关类别:
  信号通路 >> G 蛋白偶联受体/G 蛋白 >> 5-HT受体
  信号通路 >> 神经信号通路 >> 5-HT受体
  天然产物 >> 苯丙酸类
  研究领域 >> 炎症/免疫
  研究领域 >> 神经疾病
• 靶点实验:

  5-HT[1]

• 参考文献:

  [1]. Ma Z, et al. Metabolism and Metabolic Inhibition of Xanthotoxol in Human Liver Microsomes. Evid Based Complement Alternat Med. 2016;2016:5416509.

花椒毒酚,花椒毒醇物理化学性质

• 密度: 1.5±0.1 g/cm3
• 沸点: 428.1±45.0 °C at 760 mmHg
• 熔点: 250ºC
• 分子式: C₁₁H₆O₄
• 分子量: 202.163
• 闪点: 212.7±28.7 °C
• 精确质量: 202.026611
• PSA: 63.58000
• LogP: 0.72
• InChIKey: JWVYQQGERKEAHW-UHFFFAOYSA-N
• SMILES: O=c1ccc2cc3ccoc3c(O)c2o1
• 蒸汽压: 0.0±1.1 mmHg at 25°C
• 折射率: 1.711
• 储存条件: -20°C
• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:1

  3.氢键受体数量:4

  4.可旋转化学键数量:0

  5.互变异构体数量:无

  6.拓扑分子极性表面积:59.7

  7.重原子数量:15

  8.表面电荷:0

  9.复杂度:312

  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

花椒毒酚,花椒毒醇毒性和生态

花椒毒酚,花椒毒醇安全信息

• 风险声明 (欧洲): 25
• 安全声明 (欧洲): 20-45
• 危险品运输编码: UN 2810
• 海关编码: 2932999099

花椒毒酚,花椒毒醇海关

• 海关编码: 2932999099
• 中文概述: 2932999099. 其他仅含氧杂原子的杂环化合物. 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: 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

花椒毒酚,花椒毒醇靶点实验

查看更多实验

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

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

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

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

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

实验名称：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect... 来源：Broad Institute 靶标：N/A External Id：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

实验名称：Fluorescence-based cell-based primary high throughput screening assay to identify pos... 来源：The Scripps Research Institute Molecular Screening Center 靶标：muscarinic acetylcholine receptor M1 [Homo sapiens] External Id：CHRM1_PAM_FLUO8_1536_1X%ACT PRUN

实验名称：Fluorescence polarization-based biochemical high throughput primary assay to identify... 来源：The Scripps Research Institute Molecular Screening Center 靶标：RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens] External Id：SIAE_INH_FP_1536_1X%INH PRUN

实验名称：Antioxidant activity assessed as protection against Cu(2+)/GST-induced DNA damage up ... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL1166378

实验名称：Absorbance-based primary biochemical high throughput screening assay to identify acti... 来源：The Scripps Research Institute Molecular Screening Center 靶标：caspase-3 preproprotein [Homo sapiens] External Id：PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN

共127条，当前第1页，共13页

1

2

3

4

5

花椒毒酚,花椒毒醇英文别名

• 9-hydroxyfuro[3,2-g]chromen-7-one
• 8-Hydroxypsoralen
• T C566 DO LVOJ BQ
• 8-Hydroxy-4':5',6:7-furocoumarin
• 9-Hydroxy-7H-furo[3,2-g]chromen-7-one
• Xanthotoxol
• EINECS 217-923-1