Showing Metabocard for (-)-5'-demethylyatein (BASm0008006)
| Common Name | (-)-5'-demethylyatein |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C21H22O7 |
| Average Mass | 386.40000 |
| Monoisotopic Mass | 386.13655 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | COc1cc(C[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(O)c1OC |
| InChI Identifier | InChI=1S/C21H22O7/c1-24-19-9-13(7-16(22)20(19)25-2)6-15-14(10-26-21(15)23)5-12-3-4-17-18(8-12)28-11-27-17/h3-4,7-9,14-15,22H,5-6,10-11H2,1-2H3 |
| InChI Key | PFCOJAPJHVVASV-UHFFFAOYSA-N |
| CHEBI ID | CHEBI:90894 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |