5'-Deoxyuridine
Basic information
- CAS
15958-99-3- Standard SMILES
C[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O- InChIKey
WUBAOANSQGKRHF-XVFCMESISA-N- Molecular formula
- C9H12N2O5
- Average molar mass
- 228.2 g/mol
- Monoisotopic mass
- 228.07462149
Names & identifiers
- Preferred name
- 5'-Deoxyuridine
- IUPAC
- 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]pyrimidine-2,4-dione
- English name
- 5'-DEOXYURIDINE
- Molecular formula
- C9H12N2O5
- Molecular weight
- 228.2
Names & synonyms
5'-deoxyuridine15958-99-3DTXSID20332158RefChem:298018DTXCID20283252Uridine, 5'-deoxy-MFCD000750935'- Deoxyuridine1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]pyrimidine-2,4-dioneSCHEMBL6575425'-Deoxy-uridine;
Show more names
5'-Deoxyuridne1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione - [D92420]
CS-0447494A1-019351-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione5'-Deoxy-D-uridine4de75 inverted exclamation mark -Deoxyuridineorb1907820CHEMBL3250647
Database identifiers
- CAS
15958-99-3- PubChem CID
- 444437
- DTXSID
DTXSID20332158- ChEMBL
CHEMBL3250647- Nikkaji
- J462.761J
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 356
Physicochemical properties
- Density
- 1.55 · 1.550±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 9.39 · 9.39±0.10(Predicted)
- form
- Solid
- color
- White to Light Yellow
- InChI
- InChI=1S/C9H12N2O5/c1-4-6(13)7(14)8(16-4)11-3-2-5(12)10-9(11)15/h2-4,6-8,13-14H,1H3,(H,10,12,15)/t4-,6-,7-,8-/m1/s1
- InChIKey
- WUBAOANSQGKRHF-XVFCMESISA-N
- SMILES
- C[C@H]1O[C@@H](N2C=CC(=O)NC2=O)[C@H](O)[C@@H]1O
Chemistry & industry
Applications
Uses5’-Deoxyuridine is a uridine derivative used as a therapeutic agent for treating allergy, cancer, infection and autoimmune disease.
Uses5'-DEOXYURIDINE is a uridine derivative used as a therapeutic agent for treating allergy, cancer, infection and autoimmune disease
Related reactions
1 records
Compound notes
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