Introduction:Basic information about CAS 110862-48-1|(rel)-Atorvastatin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (rel)-Atorvastatin |
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| CAS Number | 110862-48-1 | Molecular Weight | 558.640 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 722.2±60.0 °C at 760 mmHg |
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| Molecular Formula | C33H35FN2O5 | Melting Point | / |
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| MSDS | / | Flash Point | 390.6±32.9 °C |
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Names
| Name | Atorvastatin |
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| Synonym | More Synonyms |
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(rel)-Atorvastatin BiologicalActivity
| Description | (rel)-Atorvastatin, a relative configuration of Atorvastatin. Atorvastatin is an orally active HMG-CoA reductase inhibitor, has the ability to effectively decrease blood lipids. Atorvastatin inhibits human SV-SMC proliferation and invasion with IC50s of 0.39 μM and 2.39 μM, respectively[1][2][3]. |
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| Related Catalog | Signaling Pathways >>Metabolic Enzyme/Protease >>HMG-CoA Reductase (HMGCR)Signaling Pathways >>Autophagy >>AutophagyResearch Areas >>Inflammation/ImmunologyResearch Areas >>Metabolic Disease |
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| References | [1]. Santodomingo-Garzón T, et al. Atorvastatin inhibits inflammatory hypernociception. Br J Pharmacol. 2006 Sep;149(1):14-22. [2]. Turner NA, et al. Comparison of the efficacies of five different statins on inhibition of human saphenous vein smooth muscle cell proliferation and invasion. J Cardiovasc Pharmacol. 2007 Oct;50(4):458-61. [3]. Nawrocki, J.W., et al., Reduction of LDL cholesterol by 25% to 60% in patients with primary hypercholesterolemia by atorvastatin, a new HMG-CoA reductase inhibitor. Arterioscler Thromb Vasc Biol, 1995. 15(5): p. 678-82. [4]. Ming-Bai Hu, et al. Atorvastatin induces autophagy in MDA-MB-231 breast cancer cells. Ultrastruct Pathol. Sep-Oct 2018;42(5):409-415. |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 722.2±60.0 °C at 760 mmHg |
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| Molecular Formula | C33H35FN2O5 |
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| Molecular Weight | 558.640 |
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| Flash Point | 390.6±32.9 °C |
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| Exact Mass | 558.252991 |
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| PSA | 111.79000 |
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| LogP | 4.13 |
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| Vapour Pressure | 0.0±2.5 mmHg at 25°C |
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| Index of Refraction | 1.603 |
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| InChIKey | XUKUURHRXDUEBC-UHFFFAOYSA-N |
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| SMILES | CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)O |
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Safety Information
Customs
Synonyms
| 1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-, (βS,δS)- |
| (3S,5S)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid |
| UNII:36TN91XZ0V |
| 1h-pyrrole-1-heptanoic acid |