Basic information
- CAS
55003-48-0- Standard SMILES
N#C[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O- InChIKey
SSVMMUXBLKOZMG-XVFCMESISA-N- Molecular formula
- C9H9N3O5
- Average molar mass
- 239.18 g/mol
- Monoisotopic mass
- 239.0542204
Names & identifiers
- Preferred name
- 1-Deoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-beta-D-ribofuranurononitrile
- IUPAC
- (2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolane-2-carbonitrile
Names & synonyms
1-Deoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-beta-D-ribofuranurononitrile55003-48-0SCHEMBL2056712beta-D-Ribofuranurononitrile, 1-deoxy-1-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-
Database identifiers
- CAS
55003-48-0- PubChem CID
- 150628
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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