chempirical

N1-Methylpseudouridine

C10H14N2O6CAS 13860-38-3258.23 g/mol

Open in Covalent MOL file
NOOHOHHOOHNO
AlcoholEtherPhenol

Properties

Molecular formula
C10H14N2O6
Molar mass
258.23 g/mol
Exact mass
258.0852 Da
logP
-2.36Crippen estimate
Polar surface area
125.0 Ų
H-bond donors / acceptors
4 / 7
Rotatable bonds
2
Stereocentres
S, R, S, Rin SMILES atom order

Identifiers

CAS number
13860-38-3
SMILES
Cn1cc([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)nc1=O
InChIKey
UVBYMVOUBXYSFV-XUTVFYLZSA-N
InChI
InChI=1S/C10H14N2O6/c1-12-2-4(9(16)11-10(12)17)8-7(15)6(14)5(3-13)18-8/h2,5-8,13-15H,3H2,1H3,(H,11,16,17)/t5-,6-,7-,8+/m1/s1

Weigh it out

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

Names and synonyms

7 names
  • 2,4(1H,3H)-Pyrimidinedione, 1-methyl-5-β-D-ribofuranosyl-
  • Uracil, 1-methyl-5-β-D-ribofuranosyl-
  • 1-Methyl-5-β-D-ribofuranosyl-2,4(1H,3H)-pyrimidinedione
  • 1-Methylpseudouridine
  • U 50228
  • NSC 240023
  • 2: PN: WO2017201317 SEQID: 2 claimed DNA

Work with N1-Methylpseudouridine

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

Pseudouridine1445-07-454 % similar 5-Hydroxyuridine957-77-753 % similar 5-Fluorouridine316-46-151 % similar 5-Bromouridine957-75-551 % similar Clevudine163252-36-650 % similar 5-Methyl-2′-O-methyluridine55486-09-449 % similar Telbivudine3424-98-448 % similar Thymidine50-89-548 % similar

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

Same formula

5-Methyluridine1463-10-1 2′-O-Methyluridine2140-76-3 5-Hydroxymethyl-2′-deoxyuridine5116-24-5 1-β-D-Arabinofuranosyl-5-methyl-2,4(1H,3H)-pyrimidinedione605-23-2 3-Methyl-5-β-D-ribofuranosyl-2,4(1H,3H)-pyrimidinedione81691-06-7

Elsewhere

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