Introduction：Basic information about CAS 531-44-2|scopolin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | scopolin |
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| CAS Number | 531-44-2 | Molecular Weight | 354.309 |
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| Density | 1.6±0.1 g/cm3 | Boiling Point | 650.2±55.0 °C at 760 mmHg |
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| Molecular Formula | C16H18O9 | Melting Point | 217ºC |
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| MSDS | / | Flash Point | 241.5±25.0 °C |
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Names
| Name | scopolin |
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| Synonym | More Synonyms |
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scopolin BiologicalActivity
| Description | Scopolin is a coumarin isolated from Arabidopsis thaliana (Arabidopsis) roots[1]. Scopolin attenuated hepatic steatosis through activation of SIRT1-mediated signaling cascades[2]. |
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| Related Catalog | Signaling Pathways >>Epigenetics >>SirtuinSignaling Pathways >>Cell Cycle/DNA Damage >>SirtuinResearch Areas >>Metabolic Disease |
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| Target | SIRT1 |
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| References | [1]. Siwinska J, et al. Identification of QTLs affecting scopolin and scopoletin biosynthesis in Arabidopsisthaliana. BMC Plant Biol. 2014 Oct 18;14:280. [2]. Yoo A, et al. Scopolin ameliorates high-fat diet induced hepatic steatosis in mice: potential involvement of SIRT1-mediated signaling cascades in the liver. Sci Rep. 2017 May 22;7(1):2251. |
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Chemical & Physical Properties
| Density | 1.6±0.1 g/cm3 |
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| Boiling Point | 650.2±55.0 °C at 760 mmHg |
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| Melting Point | 217ºC |
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| Molecular Formula | C16H18O9 |
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| Molecular Weight | 354.309 |
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| Flash Point | 241.5±25.0 °C |
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| Exact Mass | 354.095093 |
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| PSA | 138.82000 |
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| LogP | -1.87 |
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| Vapour Pressure | 0.0±2.0 mmHg at 25°C |
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| Index of Refraction | 1.639 |
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| InChIKey | SGTCGCCQZOUMJJ-YMILTQATSA-N |
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| SMILES | COc1cc2ccc(=O)oc2cc1OC1OC(CO)C(O)C(O)C1O |
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Synonyms
| Scopolin |
| 2H-1-Benzopyran-2-one, 7-(β-D-glucopyranosyloxy)-6-methoxy- |
| Scopoletin glucoside |
| 7-(β-D-glucopyranosoyloxy)-6-methoxy-2H-1-benzopyran-2-one |
| 2H-1-Benzopyran-2-one, 7- (β-D-glucopyranosyloxy)-6-methoxy- |
| 5Mg |
| 7-(b-D-Glucopyranosyloxy)-6-methoxy-2H-1-benzopyran-2-one |
| Scopoletin 7-O-Glucoside |
| 6-Methoxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside |
| 2'-β-D-glucosyl scopolin |
| Murrayin |
| Scopolin (8CI) |
| CPD-678 |
| Scopoletin 7-glucoside |
| 7β-D-Glucopyranosyloxy-6-methoxycoumarin |
| Scopoline |
| Scopoloside |
