2'-o-(2-Methoxyethyl)-5-methylcytidine

C₁₃H₂₁N₃O₆CAS 244105-55-3315.33 g/mol

Open in Covalent MOL file

Alcohol Ether Primary amine

Properties

Molecular formula: C₁₃H₂₁N₃O₆
Molar mass: 315.33 g/mol
Exact mass: 315.1430 Da
logP: -1.58Crippen estimate
Polar surface area: 129.1 Å²
H-bond donors / acceptors: 3 / 8
Rotatable bonds: 6
Stereocentres: R, R, R, 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

244105-55-3

SMILES

CC1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)OCCOC

InChIKey

GUEIFVRYWPOXHJ-DNRKLUKYSA-N

InChI

InChI=1S/C13H21N3O6/c1-7-5-16(13(19)15-11(7)14)12-10(21-4-3-20-2)9(18)8(6-17)22-12/h5,8-10,12,17-18H,3-4,6H2,1-2H3,(H2,14,15,19)/t8-,9-,10-,12-/m1/s1

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Names and synonyms

1 names

5-Methyl-2'-methoxyethoxycytosine

Work with 2'-o-(2-Methoxyethyl)-5-methylcytidine

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

2'-O-(2-Methoxyethyl)-5-methyl-uridine163759-49-764 % similar 5-Methyl-2′-O-methyluridine55486-09-462 % similar 2'-O-Moe-adenosine168427-74-558 % similar 5-Methyluridine1463-10-156 % similar 1-β-D-Arabinofuranosyl-5-methyl-2,4(1H,3H)-pyrimidinedione605-23-256 % similar 2'-O-(2-Methoxyethyl)guanosine473278-54-556 % similar 2,2'-Anhydro-1-beta-arabinofuranosylthymine22423-26-354 % similar 2'-O-(2-Methoxyethyl)uridine223777-15-954 % similar

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

Elsewhere

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