CAS Number4674-50-4
Synonyms(4R,4aS,6R)-6-Isopropenyl-4,4a-dimethyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone; EINECS 225-124-4; MFCD00036591; 4βh,5α-eremophila-1(10),11-dien-2-one; Nootkatone
Molecular FormulaC15H22O
Molecular Weight218.33
Purity≥98%
Density1.0±0.1 g/cm3
Boiling Point318.6±42.0 °C at 760 mmHg
Melting Point35-39ºC
AppearanceThick yellow liquid or crystals with a citrus odor
EINECS225-124-4
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 4674-50-4 |
| Catalog No. | 2A-9011699 |
| Chinese Name | 努特卡酮, 诺卡酮 |
| Synonyms | (4R,4aS,6R)-6-Isopropenyl-4,4a-dimethyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone; EINECS 225-124-4; MFCD00036591; 4βh,5α-eremophila-1(10),11-dien-2-one; Nootkatone |
| Molecular Formula | C15H22O |
| Molecular Weight | 218.33 |
| Purity | ≥98 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 318.6±42.0 °C at 760 mmHg |
| Melting Point | 35-39ºC |
| Appearance | Thick yellow liquid or crystals with a citrus odor |
| Water Solubility | Slightly soluble in ethanol and chloroform. Partly |
| Storage Condition | Keep away from light, ventilated and dry, sealed |
| Application | Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, has antioxidant and anti-inflammatory effects. Nootkatone improves cognitive impairment in lipopolysaccharide-induced Alzheimer's |
| EINECS | 225-124-4 |
| PubChem ID | 329830570 |
| MDL Number | MFCD04974578 |
| SMILES | C[C@@H]1CC(=O)C=C2CC[C@H](C[C@@]12C)C(C)=C |
| InChI | 1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1 |
| InChI Key | WTOYNNBCKUYIKC-JMSVASOKSA-N |
| Beilstein/REAXYS | 4676969 |
| NACRES Code | NA.21 |
| UNSPSC | 12352205 |
| Hazard Symbols | Transport |
| MSDS | msds/11699_1_4674_50_4.pdf |
| Bioactivity | Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, has antioxidant and anti-inflammatory effects[1]. Nootkatone improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease[2]. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Neurological Disease In Vivo Nootkatone (10 mg/kg) group shows good performance in behavior experiments including Y-maze test and Morris water maze test. The results of histopathological examination and immunohistochemical analysis showed that LPS induced degeneration of neurons and activation of microglia particularly in hippocampus and Nootkatone (10 mg/kg) reversed these changes. Enzyme linked immunosorbent assay and western blot analysis also demonstrated that the model group had increased expression of IL-1β, IL-6, TNF-α, NLRP3 and NF-κB p65, especially in hippocampus relative to sham-operated group, and Nootkatone (10 mg/kg) decreased the high expression of these inflammatory cytokines[1]. References [1]. Wang Y, et al. Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease. Int Immunopharmacol. 2018 Sep;62:77-85. [2]. Wang Y, et al. Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease. Int Immunopharmacol. 2018 Sep;62:77-85. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 318.6±42.0 °C at 760 mmHg Melting Point 35-39ºC Molecular Formula C15H22O Molecular Weight 218.335 Flash Point 142.1±18.7 °C Exact Mass 218.167068 PSA 17.07000 LogP 3.84 Vapour Pressure 0.0±0.7 mmHg at 25°C Index of Refraction 1.503 InChIKey WTOYNNBCKUYIKC-JMSVASOKSA-N SMILES C=C(C)C1CCC2=CC(=O)CC(C)C2(C)C1 Storage condition 2-8°C Stability Stable. Incompatible with strong oxidizing agents. Water Solubility Slightly soluble in ethanol and chloroform. Partly soluble in water. |
| Use of | Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, has antioxidant and anti-inflammatory effects[1]. Nootkatone improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease[2]. Properties Articles26 Name (+)-Nootkatone Synonym More Synonyms Nootkatone Biological Activity Description Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, has antioxidant and anti-inflammatory effects[1]. Nootkatone improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease[2]. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Neurological Disease References [1]. Wang Y, et al. Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease. Int Immunopharmacol. 2018 Sep;62:77-85. [2]. Wang Y, et al. Nootkatone, a neuroprotective agent from Alpiniae Oxyphyllae Fructus, improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease. Int Immunopharmacol. 2018 Sep;62:77-85. Chemical & Physical Properties Molecular Formula C15H22O Exact Mass 218.167068 PSA 17.07000 Index of Refraction 1.503 InChIKey WTOYNNBCKUYIKC-JMSVASOKSA-N Stability Stable. Incompatible with strong oxidizing agents. Water Solubility Slightly soluble in ethanol and chloroform. Partly soluble in water. |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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