Basic information
- Standard SMILES
OC[C@@H]1C[C@@H](O)[C@H](n2cnc3c(O)ncnc32)O1- InChIKey
RPZDLTVHZJHPAW-BAJZRUMYSA-N- Molecular formula
- C10H12N4O4
- Average molar mass
- 252.23 g/mol
- Monoisotopic mass
- 252.08585488
Names & identifiers
- IUPAC
- 9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
Database identifiers
- PubChem CID
- 159463
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 377
Related reactions
1 records
Compound notes
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