5'-O-Galactopyranosyl ribavirin
Basic information
- CAS
114283-62-4- Standard SMILES
NC(=O)c1ncn([C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)n1- InChIKey
DDEVDOFIWICGEW-FZISVMHXSA-N- Molecular formula
- C14H22N4O10
- Average molar mass
- 406.35 g/mol
- Monoisotopic mass
- 406.13359291
Names & identifiers
- Preferred name
- 5'-O-Galactopyranosyl ribavirin
- IUPAC
- 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-2-yl]-1,2,4-triazole-3-carboxamide
- English name
- 5'-O-galactopyranosyl ribavirin
- Molecular formula
- C14H22N4O10
- Molecular weight
- 406.35
Names & synonyms
5'-O-Galactopyranosyl ribavirin114283-62-45'-O-beta-D-Galactopyranosyl ribavirinDTXSID90150689RefChem:100850DTXCID80731801-(5-O-beta-D-Galactopyranosyl-beta-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxamide
Database identifiers
- CAS
114283-62-4- PubChem CID
- 196691
- DTXSID
DTXSID90150689
Properties
Computed structural properties
- XLogP
- -4
- Topological polar surface area
- 223 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 558
Physicochemical properties
- Boiling point
- 833.587 · 833.587±75.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 2.141 · 2.141±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.902 · 12.902±0.70(predicted)
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Related reactions
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Compound notes
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