2′-O-Methyladenosine

C11H15N5O4CAS 2140-79-6281.27 g/mol

Open in Covalent MOL file
OHOOHONNNH2NN
AlcoholEtherPrimary amine

Properties

Molecular formula
C11H15N5O4
Molar mass
281.27 g/mol
Exact mass
281.1124 Da
Melting point
204–206 °C
logP
-1.33Crippen estimate
Polar surface area
128.5 Ų
H-bond donors / acceptors
3 / 8
Rotatable bonds
3
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.

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Identifiers

CAS number
2140-79-6
SMILES
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21
InChIKey
FPUGCISOLXNPPC-IOSLPCCCSA-N
InChI
InChI=1S/C11H15N5O4/c1-19-8-7(18)5(2-17)20-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1

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Names and synonyms

3 names
  • 2'-O-Methyladenosine
  • Adenosine, 2′-O-methyl-
  • Cordysinin B

Work with 2′-O-Methyladenosine

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-Moe-adenosine168427-74-578 % similar Vidarabine5536-17-478 % similar Adenosine58-61-778 % similar 2-Amino-2'-O-methyladenosine80791-87-375 % similar (2R,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol20227-41-272 % similar 2'-Fluoro-2'-deoxyadenosine64183-27-372 % similar 3'-Fluoro-3'-deoxyadenosine75059-22-269 % similar 2′,3′-O-Isopropylideneadenosine362-75-466 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3′-O-Methyladenosine10300-22-8 2'-C-Methyladenosine15397-12-3 1-Methyladenosine15763-06-1 N6-Methyladenosine1867-73-8

Elsewhere

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