Introduction：Basic information about CAS 6750-60-3|Spathulenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Spathulenol |
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| CAS Number | 6750-60-3 | Molecular Weight | 220.350 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 297.0±19.0 °C at 760 mmHg |
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| Molecular Formula | C15H24O | Melting Point | / |
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| MSDS | / | Flash Point | 123.9±13.7 °C |
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Names
| Name | (1aR,4aR,7S,7aR,7bR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cycl opropa[e]azulen-7-ol |
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| Synonym | More Synonyms |
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Spathulenol BiologicalActivity
| Description | Spathulenol is isolated from Psidium guineense Sw, and has antioxidant, anti-inflammatory, antiproliferative and antimycobacterial activities. Spathulenol shows a high antioxidant activity with an IC50 of 85.60 μg/mL in the DPPH system[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
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| In Vitro | Spathulenol exhibits a high antioxidant activity s in the DPPH and MDA system, exhibits significant DPPH free radical activity, with IC50 values of 85.60 μg/mL[1]. |
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| In Vivo | Spathulenol (oral administration; 300 mg/kg) shows a significant inhibition in the Cg-induced mice paw oedema and pleurisy model[1]. In a spontaneous lipoperoxidation rat brain homogenate model, when incubated in controlled temperature andoxygenation conditions, PG-1 exhibits a high activity with an IC50 value of 26.13 μg/mL, respectively, which iscomparable to a commercial antioxidant BHT (38.41 μg/mL), Thus, PG-1 contributes to a decrease in the generation of MDA,which is a toxic product resulting from the degradation of the cell membrane by lipid peroxidation, causing cell ruptures and mutations[1]. |
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| References | [1]. Nascimento KF, et al. Antioxidant, anti-inflammatory, antiproliferative and antimycobacterial activities of the essential oil of Psidium guineense Sw. and spathulenol.J Ethnopharmacol. 2018 Jan 10;210:351-358. |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 297.0±19.0 °C at 760 mmHg |
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| Molecular Formula | C15H24O |
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| Molecular Weight | 220.350 |
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| Flash Point | 123.9±13.7 °C |
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| Exact Mass | 220.182709 |
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| PSA | 20.23000 |
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| LogP | 4.45 |
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| Vapour Pressure | 0.0±1.4 mmHg at 25°C |
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| Index of Refraction | 1.528 |
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| InChIKey | FRMCCTDTYSRUBE-ARUSPNSKSA-N |
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| SMILES | C=C1CCC2C(C3C1CCC3(C)O)C2(C)C |
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Safety Information
Synonyms
| spathulenol |
| (1aR,4aR,7S,7aR,7bR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol |
| 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aR,7S,7aR,7bR)- |
| Espatulenol |
| 10'-Apocarotenal |
