Showing Metabocard for 3-deoxyglucosone (BASm0004012)
| Common Name | 3-deoxyglucosone |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C6H10O5 |
| Average Mass | Not Available |
| Monoisotopic Mass | 162.05282 |
| IUPAC Name | (4S,5R)-4,5,6-trihydroxy-2-oxohexanal |
| Traditional Name | Not Available |
| CAS Registry Number | 4084-27-9 |
| SMILES | O=CC(=O)C[C@H](O)[C@H](O)CO |
| InChI Identifier | InChI=1S/C6H10O5/c7-2-4(9)1-5(10)6(11)3-8/h2,5-6,8,10-11H,1,3H2/t5-,6+/m0/s1 |
| InChI Key | ZGCHLOWZNKRZSN-NTSWFWBYSA-N |
| CHEBI ID | CHEBI:60777 |
| 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 |