HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Ononin
FORMONONETIN-7-O-GLUCOSIDE · Formononetin glucoside · ForMononetin-7-O-β-D-glucoside · formononetin-7-o-β-d-glucopyranoside · FORMONONETIN-7-O-BETA-D-GLUCOPYRANOSIDE · ONONIN · Ononoside · Ononin>Ononin-RM
Identifikatoren & physikalische Daten
| CAS No. | 486-62-4 |
|---|---|
| Summenformel | C22H22O9 |
| Durchschnittliche Molmasse | 430,409 g/mol |
| Monoisotopische Masse | 430,12638228 g/mol |
| SMILES | COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1 |
| InChIKey | MGJLSBDCWOSMHL-MIUGBVLSSA-N |
| PubChem CID | 442813 |
| ChEMBL | CHEMBL465980 |
| ChEBI | CHEBI:7775 |
| EC No. | 805-344-2 |
| DTXSID | DTXSID70964089 |
Chemische & physikalische Eigenschaften
| Schmelzpunkt | 216°C |
|---|---|
| Siedepunkt | 697.8±55.0 °C(Predicted) |
| Dichte | 1.482±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Hygroscopic, -20°C Freezer, Under inert atmosphere |
| Löslichkeit | DMSO (Slightly), Methanol (Slightly, Heated), Pyridine (Slightly) |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 12.71±0.70(Predicted) |
| Farbe | Off-White |
| BRN | 63067 |
| Stabilität | Hygroscopic |
| InChIKey | MGJLSBDCWOSMHL-JQQDRUSQSA-N |
| SMILES | COc1ccc(cc1)C2=COc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3C2=O |
| LogP (Verteilungskoeffizient) | 0.630 (est) |
| CAS Datenbank | 486-62-4(CAS DataBase Reference) |
Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | 3 |
|---|---|
| Zollcode | 2938900000 |
| Sicherheitshinweise (S) | 22-24/25 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
Ononin is an isoflavone compound from Glycyrrhiza uralensis is the 7-O-glucoside of Formononetin (F693200), an isoflavone found as one of the main plant estrogens in animal feed. When metabolized in the rumen this compound transforms into a potent estrogen.