Introduction：Basic information about CAS 24063-71-6|Isocurcumenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Isocurcumenol |
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| CAS Number | 24063-71-6 | Molecular Weight | 234.334 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 351.0±42.0 °C at 760 mmHg |
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| Molecular Formula | C15H22O2 | Melting Point | 142-143℃ |
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| MSDS | / | Flash Point | 147.9±22.1 °C |
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Names
| Name | 3S-(3α,3aα,6α,8aβ)-octahydro-3-methyl-8-methylene-5-(1-methylethylidene)-6H-3a,6-epoxyazulen-6-ol |
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| Synonym | More Synonyms |
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Isocurcumenol BiologicalActivity
| Description | Isocurcumenol, an estrogen receptor alpha (ERα) inhibitor isolated from Curcuma zedoaria Rhizomes, possesses anti-tumor acticity, with IC50 values of 99.1µg/mL and 178.2 µg/mL in DLA and KB cells, respectively[1][2]. |
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| Related Catalog | Signaling Pathways >>Others >>Estrogen Receptor/ERRSignaling Pathways >>Apoptosis >>Apoptosis |
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| In Vitro | Isocurcumenol (12.5-400 µg/mL, 24-48 h) dose-dependently inhibits cancer cells proliferation[1]. isocurcumenol does not exhibit any significant toxicity on normal chicken embryo fibroblast cells and lymphocytes[1]. |
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| References | [1]. Lakshmi S, et al. Antitumour Effects of Isocurcumenol Isolated from Curcuma zedoaria Rhizomes on Human and Murine Cancer Cells. Int J Med Chem. 2011;2011:253962. [2]. Resmi Mustarichiei, et al. In silico study of curcumol, curcumenol, isocurcumenol, and β-sitosterol as potential inhibitors of estrogen receptor alpha of breast cancer. Basic Medical Research. 2014 |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 351.0±42.0 °C at 760 mmHg |
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| Melting Point | 142-143℃ |
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| Molecular Formula | C15H22O2 |
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| Molecular Weight | 234.334 |
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| Flash Point | 147.9±22.1 °C |
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| Exact Mass | 234.161987 |
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| PSA | 29.46000 |
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| LogP | 3.46 |
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| Vapour Pressure | 0.0±1.7 mmHg at 25°C |
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| Index of Refraction | 1.546 |
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| InChIKey | DEBDFZGNZTYPMF-NZBPQXDJSA-N |
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| SMILES | C=C1CC2(O)OC3(CC2=C(C)C)C(C)CCC13 |
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Synonyms
| Isocurcumenol |
| 9-Isopropylidene-2-methyl-6-methylene-11-oxatricyclo[6.2.1.0]undecan-8-ol |
| isocurcomenol |
| 6H-3a,6-Epoxyazulen-6-ol, octahydro-3-methyl-8-methylene-5-(1-methylethylidene)- |
| (1S,2S,5S,8R)-9-Isopropylidene-2-methyl-6-methylene-11-oxa-tricyclo[6.2.1.01,5]undecan-8-ol |
| (3a,3aα,6α,8aβ)-5-isopropylidene-3-methyl-8-methylene-3a,6-epoxyperhydroazulen-6-ol |
| Isourecumenol |
