Introduction：Basic information about CAS 103974-74-9|Esclentic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Esclentic acid |
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| CAS Number | 103974-74-9 | Molecular Weight | 488.70 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 609.4±55.0 °C at 760 mmHg |
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| Molecular Formula | C30H48O5 | Melting Point | / |
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| MSDS | / | Flash Point | 336.4±28.0 °C |
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Names
| Name | (2α,3α)-2,3,23-Trihydroxyurs-12-en-28-oic acid |
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| Synonym | More Synonyms |
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Esclentic acid BiologicalActivity
| Description | Esculentic acid is a selective COX-2 inhibitor and has anti-inflammatory effect. Esculentic acid is a pentacyclic triterpenoid that can be extracted from the Chinese herb Phytolacca esculenta[1][2]. |
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| Related Catalog | Research Areas >>Inflammation/ImmunologySignaling Pathways >>Immunology/Inflammation >>COX |
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| Target | COX-2[1] |
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| References | [1]. Niu X, et al. Esculentic acid, a novel and selective COX-2 inhibitor with anti-inflammatory effect in vivo and in vitro. Eur J Pharmacol. 2014 Oct 5;740:532-8. [2]. Niu X, et al. Protective effects of esculentic acid against endotoxic shock in Kunming mice. Int Immunopharmacol. 2014 Nov;23(1):229-35. |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 609.4±55.0 °C at 760 mmHg |
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| Molecular Formula | C30H48O5 |
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| Molecular Weight | 488.70 |
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| Flash Point | 336.4±28.0 °C |
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| Exact Mass | 488.350189 |
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| PSA | 97.99000 |
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| LogP | 6.46 |
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| Vapour Pressure | 0.0±4.0 mmHg at 25°C |
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| Index of Refraction | 1.579 |
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| InChIKey | JXSVIVRDWWRQRT-SVOQGVCWSA-N |
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| SMILES | CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1C |
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Safety Information
Synonyms
| Urs-12-en-28-oic acid, 2,3,23-trihydroxy-, (2α,3α)- |
| (2α,3α)-2,3,23-Trihydroxyurs-12-en-28-oic acid |
| Esclentic acid |
| dodeca-2c,7t,10t-triene-1,4-diol |
