Showing Metabocard for (8S)-annullatin E (BASm0012562)
| Common Name | (8s)-annullatin e |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C12H18O3 |
| Average Mass | 210.27300 |
| Monoisotopic Mass | 210.12559 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CCCC[C@H](O)c1cccc(O)c1CO |
| InChI Identifier | InChI=1S/C12H18O3/c1-2-3-6-11(14)9-5-4-7-12(15)10(9)8-13/h4-5,7,11,13-15H,2-3,6,8H2,1H3/t11-/m0/s1 |
| InChI Key | PTXJXZCRKMFHHW-NSHDSACASA-N |
| CHEBI ID | CHEBI:195221 |
| MiMeDB ID | MMDBc0009187 |
| 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 |