5-Ethynyl uridine

C11H12N2O6CAS 69075-42-9268.22 g/mol

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NONHOOOHOHHO
AlcoholAlkyneEther

Properties

Molecular formula
C11H12N2O6
Molar mass
268.22 g/mol
Exact mass
268.0695 Da
logP
-2.87Crippen estimate
Polar surface area
124.8 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
2
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.

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Identifiers

CAS number
69075-42-9
SMILES
C#CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
InChIKey
QCWBIPKYTBFWHH-FDDDBJFASA-N
InChI
InChI=1S/C11H12N2O6/c1-2-5-3-13(11(18)12-9(5)17)10-8(16)7(15)6(4-14)19-10/h1,3,6-8,10,14-16H,4H2,(H,12,17,18)/t6-,7-,8-,10-/m1/s1

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Names and synonyms

1 names
  • 5-Ethynyluridine

Work with 5-Ethynyl uridine

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

5-Chlorouridine2880-89-967 % similar L-Uridine26287-69-456 % similar 2'-Fluorothymidine122799-38-654 % similar 2'-O-(2-Methoxyethyl)-5-methyl-uridine163759-49-750 % similar N1-Ethylpseudouridine1613529-72-846 % similar 2-Thiouridine20235-78-346 % similar N1-Benzyl pseudouridine1613530-22-544 % similar 5-Iodouridine1024-99-344 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Nooglutyl112193-35-8

Elsewhere

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