URI
- Molecular formula
- C9 H12 N2 O6
- Molecular weight (g/mol)
- 244.2
- Classification
- NATURAL_PRODUCT
Related PDB structures · 2
Names & identifiers
- IUPAC name
- URIDINE
- SMILES
- C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O
- Isomeric SMILES
- C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
- InChI
- InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1
- InChIKey
- DRTQHJPVMGBUCF-XVFCMESISA-N
- CAS
- 58-96-8
Chemical & physical properties
- HBA
- 7
- HBD
- 4
- TPSA (Ų)
- 124.78
- cLogP
- -2.85
- Chiral atoms
- 4
- Molar refractivity
- 54.33
- Rings
- 2
- Aromatic rings
- 1
- Fraction Csp³
- 0.56
- Formal charge
- 0
Calculated properties
QED0.444
NPScore0.022564126
SAScore7.012905135