chempirical

Deoxyuridine 5′-monophosphate disodium salt

C9H11N2Na2O8PCAS 42155-08-8352.15 g/mol

Open in Covalent MOL file
O−PO−OOONOHNOHONa+Na+
AlcoholEtherPhenolPhosphate

Properties

Molecular formula
C9H11N2Na2O8P
Molar mass
352.15 g/mol
Exact mass
352.0048 Da
logP
-2.06Crippen estimate
Polar surface area
151.3 Ų
H-bond donors / acceptors
4 / 7
Rotatable bonds
4
Stereocentres
R, R, Sin SMILES atom order

Identifiers

CAS number
42155-08-8
SMILES
[O-]P([O-])(=O)OC[C@H]1O[C@@H](n2ccc(O)nc2=O)C[C@@H]1O.[Na+].[Na+]
InChIKey
CWTUMDATELIIAI-CDNBRZBRSA-N
InChI
InChI=1S/C9H13N2O8P.2Na/c12-5-3-8(11-2-1-7(13)10-9(11)14)19-6(5)4-18-20(15,16)17;;/h1-2,5-6,8,12H,3-4H2,(H,10,13,14)(H2,15,16,17);;/t5-,6+,8+;;/m0../s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • 5′-Uridylic acid, 2′-deoxy-, sodium salt (1:2)
  • 5′-Uridylic acid, 2′-deoxy-, disodium salt
  • Disodium deoxyuridylate
  • 2′-Deoxyuridine 5′-phosphate disodium salt

Work with Deoxyuridine 5′-monophosphate disodium salt

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Disodium 5′-dtmp33430-62-571 % similar 2′-Deoxycytidine 5′-phosphate disodium salt13085-50-269 % similar Disodium ump3387-36-869 % similar Deoxyuridine951-78-063 % similar Thymidine 5′-diphosphate trisodium salt95648-78-562 % similar TTP tetrasodium salt3624-46-260 % similar Cytidine 5′-(trihydrogen diphosphate), 2′-deoxy-, trisodium salt, hydrate151151-32-557 % similar 2'-Deoxycytidine-5'-triphosphate trisodium salt109909-44-656 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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