Identification
| Names | 6-Geranylnaringenin |
|---|---|
| Class | Flavonoids |
| Sub-Class | Flavanones |
| Family | Alkylflavanones |
| Synonyms | 5,7,4'-Trihydroxy-6-geranylflavanone ; Mimulone ; Bonannione A |
| Chemical Formula | C25H28O5 |
| Aglycones | 6-Geranylnaringenin |
| PubChem ID | 5716903 |
| CAS ID | - |
| ChEBI ID | - |
| SMILES | CC(C)=CCCC(C)=CCC1=C(O)C2=C(O[C@@H](CC2=O)C2=CC=C(O)C=C2)C=C1O |
6-Geranylnaringenin
Physicochemical Properties
| Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Topological Polar Surface Area | miLogP | Heavy Atom Count | Rotatable Count | Molecular Volume |
|---|---|---|---|---|---|---|---|
| 408.49 | 3 | 5 | 86.99 | 6 | 30 | 6 | 385.18 |
ADME Predicted Parameters*
| Alogp98 | Polar Surface Area | Absorption | Plasma Protein Binding | Blood Brain Barrier | CYP2D6 |
|---|---|---|---|---|---|
| 6.057 | 88.677 | Low | Binder | Undefined | Inhibitor |
Toxicity Predicted Parameters*
| Software | Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Sensitisation | Hepatotoxicity |
|---|---|---|---|---|---|
| Derek Nexus | No Hit | No Hit | No Hit | Equivocal | No Hit |
| TOPKAT | Non - Carcinogen | Toxic | Non - Mutagen | Mild | Non - Toxic |
| VEGA | Non - Carcinogen | Toxicant | Non - Mutagen | Non - Sensitizer | Toxic |
* The values predicted by softwares. ADME - TOPKAT, Toxicity - Derek Nexus, TOPKAT and VEGA.