Sodium threonateProduct ingredient for Threonic acid
- Name
- Sodium threonate
- Drug Entry
- Threonic acid
- Accession Number
- DBSALT003178
- Structure
Structure for Sodium threonate (DBSALT003178)
- Synonyms
- Not Available
- UNII
- JDZ4B758OI
- CAS Number
- Not Available
- Weight
- Average: 158.085
Monoisotopic: 158.01911761 - Chemical Formula
- C4H7NaO5
- InChI Key
- BTFOHNHDTVGCQS-LJUKVTEVSA-M
- InChI
- InChI=1S/C4H8O5.Na/c5-1-2(6)3(7)4(8)9;/h2-3,5-7H,1H2,(H,8,9);/q;+1/p-1/t2-,3+;/m0./s1
- IUPAC Name
- sodium (2R,3S)-2,3,4-trihydroxybutanoate
- SMILES
- [Na+].OC[C@H](O)[C@@H](O)C([O-])=O
- External Links
- ChemSpider
- 32699988
- Predicted Properties
Property Value Source Water Solubility 1100.0 mg/mL ALOGPS logP -1.7 ALOGPS logP -2.1 Chemaxon logS 0.84 ALOGPS pKa (Strongest Acidic) 3.4 Chemaxon pKa (Strongest Basic) -3 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 100.82 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 37.18 m3·mol-1 Chemaxon Polarizability 11.18 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon