Xanthoxyloin
Modify Date: 2025-08-20 19:28:25
Xanthoxyloin structure
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Common Name | Xanthoxyloin | ||
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| CAS Number | 84-99-1 | Molecular Weight | 258.269 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 438.6±45.0 °C at 760 mmHg | |
| Molecular Formula | C15H14O4 | Melting Point | 134-135℃ (ethanol ) | |
| MSDS | N/A | Flash Point | 197.2±28.8 °C | |
Use of XanthoxyloinXanthoxyletin is a coumarin that can be isolated from Genus Zanthoxylum and Clausena. Xanthoxyletin has antioxidant and anti-inflammatory activities. Xanthoxyletin shows cytotoxic effects to cancer cells, and induces apoptosis and necrosis. Xanthoxyletin can be used for the research of cancer and inflammation[1][2]. |
| Name | 5-methoxy-2,2-dimethylpyrano[3,2-g]chromen-8-one |
|---|---|
| Synonym | More Synonyms |
| Description | Xanthoxyletin is a coumarin that can be isolated from Genus Zanthoxylum and Clausena. Xanthoxyletin has antioxidant and anti-inflammatory activities. Xanthoxyletin shows cytotoxic effects to cancer cells, and induces apoptosis and necrosis. Xanthoxyletin can be used for the research of cancer and inflammation[1][2]. |
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| Related Catalog | |
| In Vitro | Xanthoxyletin (1-500 µM；30 分钟) 抑制 DPPH 自由基的 IC50 值为 247.1 μM 和 63.8 μg/mL，对铁还原抗氧化能力 (FRAP) 的值为 45.2 μM[2]。 Xanthoxyletin (10-500µM；24 小时) 对 HepG2，HCT116 和 SK-LU-1 癌细胞具有细胞毒性，IC50 值分别为 78.2，79.8 和 94.4 μM[2]。 Xanthoxyletin (78 和 156 μM；12 和 24 小时) 诱导细胞凋亡，引起低坏死[2]。 Cell Cytotoxicity Assay[2] Cell Line: HepG2, HCT116, SK-LU-1 and Vero cell lines Concentration: 10-500 µM Incubation Time: 24 hours Result: Exhibited cytotoxicity to HepG2, HCT116 and SK-LU-1, but showed inactive effect to Vero cells. Apoptosis Analysis[2] Cell Line: HepG2 cell line[2] Concentration: 78 and 156 μM Incubation Time: 12 and 24 hours Result: Induced apoptosis percentage of 49.6% and 64.2% at the dose of 78 and 156 μM, respectively. Showed a better apoptosis inducing effect that cisplatin. |
| References |
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 438.6±45.0 °C at 760 mmHg |
| Melting Point | 134-135℃ (ethanol ) |
| Molecular Formula | C15H14O4 |
| Molecular Weight | 258.269 |
| Flash Point | 197.2±28.8 °C |
| Exact Mass | 258.089203 |
| PSA | 48.67000 |
| LogP | 3.64 |
| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
| Index of Refraction | 1.570 |
| InChIKey | JSJIIHRNDMLJGK-UHFFFAOYSA-N |
| SMILES | COc1c2c(cc3oc(=O)ccc13)OC(C)(C)C=C2 |
| Hazard Codes | Xi |
|---|---|
| HS Code | 2932999099 |
CAS#:17053-75-7
CAS#:87702-68-9
CAS#:74-88-4
CAS#:108-73-6
CAS#:883-09-0
CAS#:541-47-9
CAS#:29373-14-6
CAS#:7661-00-9| HS Code | 2932999099 |
|---|---|
| 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% |
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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|
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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|
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: 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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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: 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
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Name: Absorbance-based primary biochemical high throughput screening assay to identify acti...
Source: The Scripps Research Institute Molecular Screening Center
Target: caspase-3 preproprotein [Homo sapiens]
External Id: PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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| 5-Methoxy-8,8-dimethyl-2H,8H-pyrano[3,2-g]chromen-2-one |
| 7-Hydroxy-5-methoxy-2,2-dimethyl-2H-1-benzopyran-6-acrylic Acid d-Lactone |
| xanthoxylethine |
| Xanthoxyletin |
| 5-Methoxy-8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one |
| Xanthoxylin N |
| Xanthoxyloin |
| xanthoxylethin |