[(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)tetrahydrofuran-2-yl]methoxymethylphosphonic acid
Basic information
- CAS
129151-66-2- Standard SMILES
O=c1ccn([C@H]2CC[C@@H](COCP(=O)([O-])[O-])O2)c(=O)[nH]1- InChIKey
GLMGVORAWLDEJT-IONNQARKSA-L- Molecular formula
- C10H13N2O7P-2
- Average molar mass
- 304.19 g/mol
- Monoisotopic mass
- 304.04603776
Names & identifiers
- Preferred name
- [(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)tetrahydrofuran-2-yl]methoxymethylphosphonic acid
- IUPAC
- 1-[(2R,5S)-5-(phosphonatomethoxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Names & synonyms
129151-66-2AC1L9Q70DiNa-5'-O-Phosphonomethyl-ddUDTXSID20332350[(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)tetrahydrofuran-2-yl]methoxymethylphosphonic acidDisodium 5'-O-(Phosphonomethyl)-2',3'-dideoxyuridineUridine, 2',3'-dideoxy-5'-O-(phosphonomethyl)-, disodium salt({[(2S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-2-yl]methoxy}methyl)phosphonate
Database identifiers
- CAS
129151-66-2- PubChem CID
- 452268
- DTXSID
DTXSID20332350
Properties
Computed structural properties
- XLogP
- -2.2
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- -2
- Complexity
- 463
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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