Showing Metabocard for 2-epi-5-epi-valiolone (BASm0007068)
| Common Name | 2-epi-5-epi-valiolone |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C7H12O6 |
| Average Mass | 192.16700 |
| Monoisotopic Mass | 192.06339 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | O=C1C[C@@](O)(CO)[C@@H](O)[C@H](O)[C@@H]1O |
| InChI Identifier | InChI=1S/C7H12O6/c8-2-7(13)1-3(9)4(10)5(11)6(7)12/h4-6,8,10-13H,1-2H2/t4-,5-,6+,7-/m1/s1 |
| InChI Key | JCZFNXYQGNLHDQ-MVIOUDGNSA-N |
| CHEBI ID | CHEBI:84187 |
| MiMeDB ID | MMDBc0055221 |
| State | Expected Solid |
| 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 |