Inosine

• CAS: 58-63-9
• Catalog Number: ACM58639
• Category: Other Products
• Molecular Weight: 268.23
• Molecular Formula: C10H12N4O5
• Synonyms: Hypoxanthined-riboside
• IUPAC Name: 9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one
• Canonical SMILES: C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)CO)O)O
• InChI: InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s1
• InChI Key: UGQMRVRMYYASKQ-KQYNXXCUSA-N
• Boiling Point: 226 °C
• Melting Point: 222-226 °C(lit.)
• Flash Point: 397 °C
• Density: 1.3846 g/cm³
• Appearance: White crystalline powder
• Storage: Keep in dark place, sealed in dry, room temperature
• Active Content: 95%
• Assay: 0.99
• Complexity: 405
• Exact Mass: 268.08076950
• Hazard Statements: Xi
• Isomeric SMILES: C1=NC2=C(C(=O)N1)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O
• Monoisotopic Mass: 268.08076950
• Packaging: 1 kg
• Physical State: Solid
• pKa: 13.24±0.70(Predicted)
• Refractive Index: -52 ° (C=1, H₂O)
• Safety Description: 24/25-36-26
• Solubility In Water: 2.1 g/100mL (20 ºC)
• Stability: Stable under normal temperatures and pressures.
• Storage Conditions: Store at RT.
• Topological Polar Surface Area: 129 Ų

Custom Q&A

What is the molecular formula of inosine?

The molecular formula of inosine is C10H12N4O5.

What is the molecular weight of inosine?

The molecular weight of inosine is 268.23 g/mol.

What is the IUPAC Name of inosine?

The IUPAC Name of inosine is 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one.

What is the InChIKey of inosine?

The InChIKey of inosine is UGQMRVRMYYASKQ-KQYNXXCUSA-N.

What is the Canonical SMILES of inosine?

The Canonical SMILES of inosine is C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)CO)O)O.

What is the CAS number of inosine?

The CAS number of inosine is 58-63-9.

How many hydrogen bond donor counts does inosine have?

Inosine has 4 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does inosine have?

Inosine has 7 hydrogen bond acceptor counts.

What is the XLogP3 value of inosine?

The XLogP3 value of inosine is -1.3.

What is the role of inosine as described in the reference?

Inosine has a role as a human metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, and a mouse metabolite.