Uridine 5'-triphosphate disodium salt

C₉H₁₃N₂Na₂O₁₅P₃CAS 285978-18-9528.10 g/mol

Open in Covalent MOL file

Alcohol Ether Phosphate

Properties

Molecular formula: C₉H₁₃N₂Na₂O₁₅P₃
Molar mass: 528.10 g/mol
Exact mass: 527.9324 Da
logP: -9.76Crippen estimate
Polar surface area: 270.0 Å²
H-bond donors / acceptors: 5 / 13
Rotatable bonds: 8
Stereocentres: R, R, S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

285978-18-9

SMILES

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OP(=O)(O)[O-])O)O.[Na+].[Na+]

InChIKey

JFXKPFPIFSFLOU-WFIJOQBCSA-L

InChI

InChI=1S/C9H15N2O15P3.2Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1

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Names and synonyms

1 names

Uridine-13C9, 15N2-5 triphosphate sodi U

Work with Uridine 5'-triphosphate 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

Diquafosol tetrasodium211427-08-678 % similar Uridine-5'-diphosphoglucose disodium117756-22-666 % similar UDP-a-D-Galactose disodium salt137868-52-166 % similar 2'-Deoxyuridine-5'-diphosphate sodium salt102814-06-264 % similar Cytidine-5'-diphosphate disodium salt54394-90-061 % similar Cytidine-5'-triphosphate disodium salt123334-07-660 % similar Uridine-5′-diphosphate disodium salt27821-45-060 % similar Uridine-5′-triphosphate trisodium salt19817-92-658 % similar

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

Elsewhere

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