HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 176907Erstellt: 27. Oktober 2026
(+-)-Dihydrodaidzein
Dihydrodaidzein>(±)-Dihydrodaidzein · DIHYDRODAIDZEIN hplc · Dihydrodaidzein standard · Dihydrodaidzein, 10 mM in DMSO · 7-hydroxy-3-(4-hydroxyphenyl)chroman-4-one · 7-Hydroxy-3-(4-hydroxyphenyl)-4-chromanone · 7-hydroxy-3-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one · inhibit,Endogenous Metabolite,Dihydrodaidzein,Inhibitor
https://huagongshe.com/de/chemical/176907
Identifikatoren & physikalische Daten
| CAS No. | 17238-05-0 |
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| Summenformel | C15H12O4 |
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| Durchschnittliche Molmasse | 256,25 g/mol |
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| Monoisotopische Masse | 256,07355886 g/mol |
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| SMILES | O=C1c2ccc(O)cc2OCC1c1ccc(O)cc1 |
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| InChIKey | JHYXBPPMXZIHKG-UHFFFAOYSA-N |
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| PubChem CID | 176907 |
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| ChEBI | CHEBI:75842 |
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| EC No. | 112-251-4 |
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| DTXSID | DTXSID70912308 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
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| Polarare Oberfläche (TPSA) | 66,8 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 19 |
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| Formalladung | 0 |
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| Komplexität | 335 |
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| Lipide | Polyketides [PK] -> Flavonoids [PK12] -> Isoflavonoids [PK1205] |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 250 °C250-251°C |
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| Physical Description | Solid |
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| Siedepunkt | 529.5±50.0 °C(Predicted) |
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| Dichte | 1.386±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | -20°C Freezer, Under Inert Atmosphere |
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| Löslichkeit | ≤0.1mg/ml in ethanol30mg/ml in DMSO10mg/ml in dimethyl formamide |
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| pKa (Säurekonstante) | 7.71±0.40(Predicted) |
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| Aggregatzustand | powder to crystal |
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| Farbe | Light orange to Yellow to Green |
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| Biologische Quelle | synthetic |
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| InChI | 1S/C15H12O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-7,13,16-17H,8H2 |
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| InChIKey | JHYXBPPMXZIHKG-UHFFFAOYSA-N |
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| SMILES | O1CC(C(=O)c3c1cc(cc3)O)c2ccc(cc2)O |
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| CAS Datenbank | 17238-05-0 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Zollcode | 2932990090 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2 |
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Anwendungen & Verwendung
Verwenden
Daidzein is an isoflavonoid phytoestrogenic compound found in soybeans, pea pods, clover, kudzu, and other legumes. Dihydrodaidzein is an active, estrogenic metabolite of daidzein. It has vasodilatory action on rat isolated aortic rings at 1 μg/ml. It stimulates the estrogen receptor-dependent growth of breast cancer MCF-7 cells at micromolar concentrations. Dihydrodaidzein is produced by the metabolism of daidzein in colonic bacteria and may be further metabolized to various bioactive compounds, including equol .
