Ribocitrin sodium salt

Base Information

• Chemical Name: Ribocitrin sodium salt
• CAS No.: 78798-55-7
• Molecular Formula: C₂₂H₃₁O₁₉*3Na
• Molecular Weight: 668.446
• DSSTox Substance ID: DTXSID801000025

Synonyms:Ribocitrin sodium salt;78798-55-7;1,2,4-Butanetricarboxylic acid, 2-((O-alpha-D-ribofuranosyl-(1-2)-O-alpha-D-ribofuranosyl-(1-3)-alpha-D-ribofuranosyl)oxy)-, (S)-, trisodium salt, hydrate;C22H31O19.3Na.H2O;DTXSID801000025;C22-H31-O19.3Na.H2-O;Trisodium 2-{[pentofuranosyl-(1->2)-[pentofuranosyl-(1->3)]pentofuranosyl]oxy}butane-1,2,4-tricarboxylate

Chemical Property of Ribocitrin sodium salt

Chemical Property:

• Boiling Point: 947.6°Cat760mmHg
• Flash Point: 315.4°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 12
• Exact Mass: 668.11526160
• Heavy Atom Count: 44
• Complexity: 901

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC(CC(=O)[O-])(C(=O)[O-])OC1C(C(C(O1)CO)OC2C(C(C(O2)CO)O)O)OC3C(C(C(O3)CO)O)O)C(=O)[O-].[Na+].[Na+].[Na+]
• Isomeric SMILES: C(CC(CC(=O)[O-])(C(=O)[O-])O[C@@H]1[C@@H]([C@@H]([C@H](O1)CO)O[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)C(=O)[O-].[Na+].[Na+].[Na+]

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