Showing Metabocard for S-methyl-5'-thioinosine (BASm0002243)
| Common Name | S-methyl-5'-thioinosine |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C11H14N4O4S |
| Average Mass | 298.32000 |
| Monoisotopic Mass | 298.07358 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CSC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O |
| InChI Identifier | InChI=1S/C11H14N4O4S/c1-20-2-5-7(16)8(17)11(19-5)15-4-14-6-9(15)12-3-13-10(6)18/h3-5,7-8,11,16-17H,2H2,1H3,(H,12,13,18)/t5-,7-,8-,11-/m1/s1 |
| InChI Key | GXYLOXCSJFJFKA-IOSLPCCCSA-N |
| CHEBI ID | CHEBI:48595 |
| MiMeDB ID | MMDBc0056304 |
| 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 |