531-95-3
equol
CAS: 531-95-3
Molecular Formula: C15H14O3
531-95-3 - Names and Identifiers
| Name | equol |
| Synonyms | Equol equol S-Equol S,R-equol R,S-EQUOL CCRIS 9222 (-)-(S)-EQUOL 7,4'-Isoflavandiol 4',7-ISOFLAVANDIOL 4',7-DIHYDROXYISOFLAVAN (S)-4',7-DIHYDROXYISOFLAVANCE 3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol 3-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-ol (3S)-3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol (S)-3,4-DYHYDRO-3-(4-HYDROXYPHENYL)-2H-1-BENZOPYRAN-7-OL (S)-3,4-Dihydro-3-(4-hydroxyphenyl)-2H-1-benzopyran-7-ol 3,4-Dihydro-3-(4-hydroxyphenyl)-(S)-2H-1-benzopyran-7-ol |
| CAS | 531-95-3 |
| EINECS | 208-522-2 |
| InChI | InChI=1/C15H14O3/c16-13-4-1-10(2-5-13)12-7-11-3-6-14(17)8-15(11)18-9-12/h1-6,8,12,16-17H,7,9H2 |
531-95-3 - Physico-chemical Properties
| Molecular Formula | C15H14O3 |
| Molar Mass | 242.27 |
| Density | 1.1914 (rough estimate) |
| Melting Point | 189-190°C |
| Boling Point | 312.25°C (rough estimate) |
| Specific Rotation(α) | D -21.5° |
| Flash Point | 220.9°C |
| Solubility | DMSO (Soluble), Ethanol (Slightly), Methanol (Slightly) |
| Vapor Presure | 2.05E-08mmHg at 25°C |
| Appearance | Solid |
| Color | White to Pale Yellow |
| pKa | 9.94±0.40(Predicted) |
| Storage Condition | Inert atmosphere,2-8°C |
| Refractive Index | 1.5557 (estimate) |
| Physical and Chemical Properties | White crystalline powder, soluble in methanol, ethanol, DMSO and other organic solvents, derived from the synthesis of daidzein, activity is stronger than daidzein. |
| In vitro study | Equol is a metabolite produced by the action of daidzein by the intestinal flora. Equol has a high affinity for the estrogen receptor (including ERalpha and ERbeta). There are two enantiomeric forms of Equol, R-equol and S-equol. S-equol has a high affinity and preferentially binds to ERbeta with a K I of 16 nM, while R-equol has a weak binding and preferentially binds to ERalpha with a K I of 50 nM. The antioxidant activity of Equol was better than that of all other isoflavones. Equol has anti-estrogenic properties. Equol was 100 times more effective than daidzein in stimulating the estrogen response. Equol in conjunction |
| In vivo study | (-)-(S)-Equol inhibits the tumor growth by 43.2% and 28.4% compared to the control on day 33, suggesting that the compound is not overtly toxic. |
531-95-3 - Risk and Safety
| WGK Germany | 3 |
| FLUKA BRAND F CODES | 3-10 |
531-95-3 - Reference
| Reference Show more | 1. [IF=5.396] Cong Lu et al."S-equol, a metabolite of dietary soy isoflavones, alleviates lipopolysaccharide-induced depressive-like behavior in mice by inhibiting neuroinflammation and enhancing synaptic plasticity."Food Funct. 2021 Jul;12(13):5770-5778 |
531-95-3 - Preparation solution concentration reference
| 1mg | 5mg | 10mg | |
|---|---|---|---|
| 1 mM | 4.128 ml | 20.638 ml | 41.276 ml |
| 5 mM | 0.826 ml | 4.128 ml | 8.255 ml |
| 10 mM | 0.413 ml | 2.064 ml | 4.128 ml |
| 5 mM | 0.083 ml | 0.413 ml | 0.826 ml |
Last Update：2024-01-02 23:10:35
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Mobile: 18021002903
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Product Name: Quinine Visit Supplier Webpage Request for quotationCAS: 130-95-0
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