disodium hydrate [(2R,3S,4R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate

• ChemBase ID: 133335
• Molecular Formular: C5H11Na2O9P
• Molecular Mass: 292.088741
• Monoisotopic Mass: 291.99360712
• SMILES: C([C@@H]1[C@H]([C@H](C(O1)O)O)O)OP(=O)([O-])[O-].O.[Na+].[Na+]
• Canonical SMILES: O[C@H]1C(O)O[C@@H]([C@H]1O)COP(=O)([O-])[O-].O.[Na+].[Na+]
• InChI: InChI=1S/C5H11O8P.2Na.H2O/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7;;;/h2-8H,1H2,(H2,9,10,11);;;1H2/q;2*+1;/p-2/t2-,3-,4-,5?;;;/m1.../s1
• InChIKey: HKCYZJCJVGKHNA-IREXRYMASA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: disodium hydrate [(2R,3S,4R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
• IUPAC Traditional name: disodium hydrate [(2R,3S,4R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
• Synonyms: D-Ribofuranose 5-phosphate disodium salt; D-Ribose 5-phosphate disodium salt hydrate

Database IDs

• MDL Number: MFCD03791300
• Beilstein Number: 4774244
• PubChem SID: 162227612; 24899398
• PubChem CID: 16219932

CALCULATED PROPERTIES

• Acid pKa: 1.2226866
• H Acceptors: 7
• H Donor: 3
• LogD (pH = 5.5): -4.8677535
• LogD (pH = 7.4): -5.958126
• Log P: -2.4257703
• Molar Refractivity: 38.5904 cm^3
• Polarizability: 17.04224 Å^3
• Polar Surface Area: 142.34 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: white powder

Safety Information

• German water hazard class: 3
• Storage Temperature: -20°C

Product Information

• Purity: ≥98% (TLC)

DETAILS

Sigma Aldrich - R7750

Biochem/physiol Actions
Ribose-5-phosphate is an intermediate of the oxidative branch of the Pentose Phosphate Pathway(PPP) and an end product of the nonoxidative branch of the PPP. Ribose-5-phosphate is used in the synthesis of nucleotides and nucleic acids.
包装
10 mg in autosmp vl